data_2la7_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 2la7 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 . . . . . 0 C--O 1.236 0.353 0 CA-C-O 121.125 0.488 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -161.52 143.36 8.76 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 124.591 1.156 . . . . 0.0 108.916 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -80.95 -31.83 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.714 2.943 . . . . 0.0 111.844 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.2 56.8 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.349 1.059 . . . . 0.0 110.707 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 21' ' ' GLN . . . -154.56 -41.18 0.09 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 129.69 3.196 . . . . 0.0 107.024 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.13 21.45 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.018 1.327 . . . . 0.0 113.766 177.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' A' ' 19' ' ' ALA . 11.7 pt20 -120.34 1.48 10.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.668 2.787 . . . . 0.0 111.428 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mp -113.2 2.27 15.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 129.199 3.0 . . . . 0.0 109.341 175.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -81.51 67.71 7.57 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.628 1.571 . . . . 0.0 107.891 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.57 -48.52 0.76 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 122.975 0.51 . . . . 0.0 111.032 -173.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.12 65.75 0.92 Allowed 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.4 p -135.67 171.09 14.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.229 1.012 . . . . 0.0 109.592 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 m -156.12 148.91 24.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.335 -2.103 . . . . 0.0 107.557 -178.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -158.67 154.46 26.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -161.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -134.93 129.22 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -76.81 130.28 37.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 106.174 -1.788 . . . . 0.0 106.174 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -123.05 -16.39 7.03 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -156.58 147.29 21.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 119.423 1.01 . . . . 0.0 108.917 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -135.67 115.2 12.71 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.32 145.69 27.83 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.088 0.955 . . . . 0.0 109.453 174.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -79.45 167.07 21.31 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.918 0.487 . . . . 0.0 110.333 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.69 70.43 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.632 0.773 . . . . 0.0 112.909 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -85.39 -30.25 23.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.23 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 139.59 -0.74 2.25 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-O 118.434 -1.203 . . . . 0.0 115.065 176.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.5 m -64.79 108.64 1.8 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 120.822 2.311 . . . . 0.0 109.758 176.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.53 110.13 1.38 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.037 0.535 . . . . 0.0 109.737 165.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 42.7 mtt-85 -63.72 171.69 2.56 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.15 1.38 . . . . 0.0 110.106 173.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.84 127.08 43.55 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 m -129.8 155.23 80.79 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.605 0.762 . . . . 0.0 109.566 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.35 103.48 1.69 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.62 2.213 . . . . 0.0 110.257 178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.2 m -61.1 158.25 14.14 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 166.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.7 -17.13 62.67 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.172 0.989 . . . . 0.0 113.467 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -72.39 -12.07 60.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.641 0.655 . . . . 0.0 112.662 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.0 -22.04 18.8 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 -165.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.39 -9.42 8.28 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 164.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.78 76.21 3.83 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.418 1.887 . . . . 0.0 110.031 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.93 160.97 46.11 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 123.897 3.065 . . . . 0.0 111.678 -178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -89.23 107.01 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 124.077 0.951 . . . . 0.0 109.313 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.1 p -112.39 154.33 25.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.914 1.286 . . . . 0.0 109.596 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.22 143.07 50.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 127.724 2.41 . . . . 0.0 106.627 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.2 m -137.3 128.57 27.97 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 68.0 mt -120.09 118.56 30.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 104.858 -2.275 . . . . 0.0 104.858 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -168.71 168.36 10.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -75.29 48.66 0.43 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.051 0.94 . . . . 0.0 110.636 168.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -69.93 -20.66 63.34 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 112.402 -171.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.2 p -98.21 -0.02 44.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.54 1.136 . . . . 0.0 111.459 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.44 -17.16 57.09 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.972 1.748 . . . . 0.0 111.955 -161.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -122.51 170.19 10.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.901 1.85 . . . . 0.0 110.87 -175.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -71.53 81.46 0.81 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 123.725 0.81 . . . . 0.0 109.913 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -126.32 113.4 16.88 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.86 1.264 . . . . 0.0 107.69 -170.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.64 148.63 51.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.534 169.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 p -147.19 165.67 29.31 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 125.084 1.354 . . . . 0.0 107.744 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 165.53 -174.75 41.32 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -122.66 113.98 19.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.3 m -125.57 94.41 4.13 Favored 'General case' 0 CA--C 1.516 -0.36 0 O-C-N 123.685 0.616 . . . . 0.0 110.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.0 -101.93 1.4 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 108.077 -2.009 . . . . 0.0 108.077 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -138.07 25.98 2.72 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.819 1.31 . . . . 0.0 111.187 164.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -140.79 128.48 21.57 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 -170.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -73.42 147.83 43.86 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.803 -0.561 . . . . 0.0 110.304 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -123.72 169.32 11.63 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 125.143 1.377 . . . . 0.0 110.373 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -161.17 169.13 22.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.953 1.701 . . . . 0.0 109.189 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.21 173.62 25.0 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.642 1.591 . . . . 0.0 110.127 166.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.5 p -79.46 165.45 23.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.275 1.038 . . . . 0.0 111.021 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.3 p90 -140.34 174.54 10.41 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.154 0.582 . . . . 0.0 111.449 172.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.73 150.82 26.61 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.612 1.565 . . . . 0.0 109.072 174.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.67 128.55 55.33 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 123.887 0.875 . . . . 0.0 108.829 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.7 ptpt -164.14 162.22 22.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.35 1.86 . . . . 0.0 109.002 173.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.409 ' HB2' ' HZ2' ' A' ' 84' ' ' LYS . 2.1 m-20 52.2 22.55 1.99 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.579 2.352 . . . . 0.0 114.749 174.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.62 12.79 84.11 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-O 118.388 -1.229 . . . . 0.0 112.973 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.409 ' HZ2' ' HB2' ' A' ' 82' ' ' ASP . 14.8 pttm -124.98 171.01 10.56 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.588 1.555 . . . . 0.0 112.47 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.7 tp -109.94 100.14 9.14 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.832 1.653 . . . . 0.0 107.237 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 m -79.22 155.98 28.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -120.36 159.13 25.67 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.44 0.696 . . . . 0.0 109.802 173.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.9 -155.95 30.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.7 m -63.17 95.6 0.09 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.523 1.129 . . . . 0.0 108.965 166.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.5 mt -79.41 175.46 10.58 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 126.281 1.832 . . . . 0.0 110.571 168.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.88 177.33 33.9 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 168.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.25 -132.18 1.97 Allowed Glycine 0 CA--C 1.522 0.508 0 CA-C-O 118.234 -1.314 . . . . 0.0 110.291 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.3 p -143.78 156.2 44.42 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.147 1.779 . . . . 0.0 111.032 -173.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -103.55 61.29 0.76 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 122.146 0.974 . . . . 0.0 108.526 -163.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 18.7 mtm -71.03 172.12 9.66 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 167.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -131.73 124.81 30.52 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.544 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 6.3 m -118.16 8.39 12.35 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 117.317 -1.325 . . . . 0.0 113.067 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 25.4 ptp 44.67 41.14 4.66 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.208 1.803 . . . . 0.0 113.869 173.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.01 156.15 65.26 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.09 0.956 . . . . 0.0 109.838 -167.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.24 -36.92 6.47 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.211 2.608 . . . . 0.0 110.924 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.26 -3.97 89.82 Favored Glycine 0 C--O 1.219 -0.834 0 CA-C-O 117.436 -1.758 . . . . 0.0 111.289 174.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.47 -61.06 1.74 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-N 120.897 2.349 . . . . 0.0 111.888 170.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.99 -18.4 63.24 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -172.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -61.26 -8.01 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.976 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -44.42 -48.73 9.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 119.276 0.944 . . . . 0.0 111.073 162.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.94 -52.38 52.61 Favored Glycine 0 C--N 1.337 0.595 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.82 -43.95 97.83 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.517 0.727 . . . . 0.0 110.631 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -62.17 -48.43 80.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.29 1.036 . . . . 0.0 109.944 -173.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.0 mt -59.83 -37.21 78.57 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.312 0.505 . . . . 0.0 110.741 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -16.75 64.38 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.34 -7.17 32.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.064 1.345 . . . . 0.0 111.618 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.67 -13.39 54.25 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.181 1.355 . . . . 0.0 111.66 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -5.06 59.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.43 1.092 . . . . 0.0 113.445 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -134.33 78.58 1.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.421 1.089 . . . . 0.0 108.408 -171.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 27.5 mm -103.71 35.6 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.081 1.352 . . . . 0.0 110.337 -172.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -23.35 67.18 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.527 -1.983 . . . . 0.0 113.605 -164.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -124.5 158.3 33.23 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.156 1.382 . . . . 0.0 109.025 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 51.6 m -155.56 124.83 6.25 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.051 -1.031 . . . . 0.0 110.943 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -101.61 131.15 10.48 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 127.311 2.386 . . . . 0.0 110.383 171.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -137.48 138.29 44.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 O-C-N 120.223 -1.751 . . . . 0.0 107.974 159.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.85 97.25 5.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 169.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 29.7 mtp -76.73 -5.51 48.37 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 127.06 30.29 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.578 1.551 . . . . 0.0 108.599 158.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.0 137.97 53.39 Favored Pre-proline 0 N--CA 1.445 -0.72 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -83.45 110.21 1.77 Allowed 'Cis proline' 0 CA--C 1.536 0.615 0 CA-C-N 120.615 1.255 . . . . 0.0 111.675 9.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -68.66 129.67 40.62 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.93 1.292 . . . . 0.0 111.374 -164.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -141.26 112.1 7.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.549 0.69 . . . . 0.0 109.449 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 56.4 ttp -75.96 157.09 33.54 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.1 112.0 5.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 121.381 -0.824 . . . . 0.0 109.596 177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 79.2 mt -86.72 156.78 19.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.1 t -142.72 137.81 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.49 167.35 10.67 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -62.08 -19.92 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.008 1.323 . . . . 0.0 113.327 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.33 -32.55 60.96 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.003 0.82 . . . . 0.0 109.865 172.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.63 0.51 20.04 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 117.84 -1.534 . . . . 0.0 113.425 -165.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.37 159.07 13.18 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.025 1.913 . . . . 0.0 108.784 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 m -138.45 141.07 39.5 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.666 1.121 . . . . 0.0 109.088 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -132.78 111.39 11.07 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 120.423 -1.423 . . . . 0.0 108.179 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.3 m -88.47 118.65 28.26 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 124.94 1.296 . . . . 0.0 110.238 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -110.25 139.77 45.09 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.891 0.876 . . . . 0.0 110.742 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.99 153.99 33.97 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 160.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -69.75 147.49 50.41 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 158.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 1.6 t -138.81 101.39 4.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 p -81.31 -5.27 57.64 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 . . . . . 0 C--O 1.254 1.301 0 CA-C-O 117.105 -1.426 . . . . 0.0 111.144 -142.178 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 . . . . . 0 CA--C 1.543 0.68 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -125.13 144.04 46.09 Favored Pre-proline 0 N--CA 1.474 0.772 0 O-C-N 121.405 -0.809 . . . . 0.0 112.621 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.06 -23.17 18.6 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.711 2.941 . . . . 0.0 111.977 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.45 -25.72 2.8 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.198 1.399 . . . . 0.0 113.729 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.72 -2.38 57.01 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.065 -1.022 . . . . 0.0 113.311 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 m -56.03 -59.04 5.48 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 119.168 0.895 . . . . 0.0 110.44 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -14.96 12.09 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.3 -5.62 58.69 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 118.714 0.688 . . . . 0.0 109.573 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.96 -11.85 61.09 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 120.844 -1.16 . . . . 0.0 112.418 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.07 -8.12 46.84 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -167.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -138.18 62.72 1.56 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.486 1.914 . . . . 0.0 106.61 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.2 p -141.34 -176.13 4.6 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 120.611 -1.306 . . . . 0.0 110.97 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 8.1 m -144.81 -60.08 0.36 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.901 176.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.405 ' HA ' ' H ' ' A' ' 143' ' ' SER . 7.1 m95 68.68 159.54 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.128 1.371 . . . . 0.0 112.217 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 t -136.61 129.38 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.1 tp -67.75 151.18 47.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 t -144.46 -23.36 0.53 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.06 146.13 29.9 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 121.202 1.819 . . . . 0.0 110.188 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -135.66 110.84 8.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.8 139.19 34.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -64.68 -170.17 0.05 OUTLIER 'General case' 0 C--O 1.237 0.436 0 CA-C-N 118.729 0.695 . . . . 0.0 110.559 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.71 -28.91 65.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.276 -1.515 . . . . 0.0 113.521 174.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -81.81 -45.47 15.53 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 123.242 1.496 . . . . 0.0 111.216 -165.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 140.81 -5.1 2.5 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 128.107 2.765 . . . . 0.0 112.709 -166.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -62.32 99.91 0.16 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.818 1.309 . . . . 0.0 109.689 167.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.73 122.29 12.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 159.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.7 156.05 35.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.82 146.56 53.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 162.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.6 m -141.31 156.29 67.45 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 161.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.608 1.539 . . . . 0.0 109.307 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.08 159.44 11.74 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.52 -1.363 . . . . 0.0 108.739 163.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.776 0.43 . . . . 0.0 111.552 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -19.78 66.05 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -65.86 -16.31 63.71 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.231 0.612 . . . . 0.0 112.638 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.29 -45.77 0.88 Allowed Glycine 0 C--N 1.337 0.628 0 C-N-CA 125.518 1.533 . . . . 0.0 111.174 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.39 86.7 2.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.565 -155.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.07 161.27 46.6 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.814 2.343 . . . . 0.0 111.634 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.3 mt -80.36 108.48 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 125.539 1.536 . . . . 0.0 109.05 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.2 p -91.85 169.79 10.4 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 122.178 0.989 . . . . 0.0 110.649 172.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -130.58 167.33 18.89 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 161.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 10.7 m -145.64 133.6 21.36 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 170.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.4 mt -133.0 82.15 1.98 Allowed 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 t -150.23 -154.97 0.59 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.942 1.297 . . . . 0.0 107.755 175.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.3 p -128.78 43.37 3.16 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.293 1.437 . . . . 0.0 111.993 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.8 t -57.16 -41.84 79.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.466 -1.396 . . . . 0.0 112.461 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.474 ' HG1' ' CD2' ' A' ' 64' ' ' HIS . 21.1 p -76.75 -31.62 57.21 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 120.415 -1.428 . . . . 0.0 110.259 172.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 124.19 -23.86 6.39 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 127.986 2.708 . . . . 0.0 111.243 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -82.44 165.33 20.32 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.693 1.246 . . . . 0.0 109.079 170.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -74.37 80.13 1.88 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.474 ' CD2' ' HG1' ' A' ' 60' ' ' THR . 0.2 OUTLIER -117.33 155.89 28.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 120.365 -1.46 . . . . 0.0 111.07 171.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.66 144.33 28.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 p -150.63 65.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 122.514 1.149 . . . . 0.0 110.23 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -103.57 -175.98 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.272 0.939 . . . . 0.0 111.394 -172.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.42 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 35.9 t80 -109.35 119.42 39.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 168.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.05 168.78 10.4 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 171.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.89 -42.73 8.0 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 -144.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 49.4 t -129.38 -5.96 4.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.596 1.198 . . . . 0.0 112.67 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.416 ' ND2' ' H ' ' A' ' 95' ' ' MET . 4.5 m120 -131.6 123.19 27.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.42 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.3 mtt-85 -56.98 169.77 0.49 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.088 0.555 . . . . 0.0 111.863 177.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -142.19 156.21 45.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.832 175.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -154.15 155.54 35.52 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.763 1.225 . . . . 0.0 109.206 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.75 -98.32 0.11 Allowed Glycine 0 C--O 1.228 -0.273 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 7.9 m -162.75 154.28 17.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.097 1.759 . . . . 0.0 108.017 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -139.11 167.55 21.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.462 1.028 . . . . 0.0 111.519 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.76 143.05 26.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.651 1.18 . . . . 0.0 108.298 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.64 116.35 28.97 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 166.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -150.99 162.06 41.55 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.811 1.245 . . . . 0.0 107.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 56.14 26.32 10.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.352 1.461 . . . . 0.0 113.612 166.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.83 21.08 65.0 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.463 -1.187 . . . . 0.0 112.814 -175.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -135.93 166.78 22.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.389 1.594 . . . . 0.0 112.18 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.28 145.12 44.24 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 164.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -141.6 161.85 36.91 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.175 -0.953 . . . . 0.0 108.762 167.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -130.67 164.04 25.89 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.353 0.661 . . . . 0.0 111.107 -174.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.05 -151.68 26.89 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 125.171 1.367 . . . . 0.0 110.051 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 t -66.66 121.23 14.93 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 171.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -111.26 166.84 10.75 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.569 1.948 . . . . 0.0 110.852 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 163.86 -167.48 37.96 Favored Glycine 0 CA--C 1.523 0.574 0 O-C-N 121.774 -0.579 . . . . 0.0 111.784 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -178.86 -156.79 18.05 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 126.164 1.84 . . . . 0.0 109.209 -176.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.7 t -90.8 170.37 10.16 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.667 1.233 . . . . 0.0 108.768 160.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.2 mtm180 -118.06 85.56 2.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 164.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.416 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 15.1 mtm -82.2 154.45 25.44 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.41 122.79 30.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 57.4 m -123.86 -32.57 3.27 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 123.809 0.844 . . . . 0.0 111.761 -170.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 16.9 ptp 45.88 56.05 6.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.909 1.684 . . . . 0.0 111.854 -175.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.7 p -144.07 159.59 52.31 Favored Pre-proline 0 C--O 1.238 0.471 0 C-N-CA 124.079 0.952 . . . . 0.0 110.847 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.29 -29.57 13.91 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.765 2.31 . . . . 0.0 111.657 174.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.14 -7.08 84.23 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.316 -0.865 . . . . 0.0 111.102 167.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.95 -42.67 4.64 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 120.202 2.001 . . . . 0.0 111.549 173.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.66 -19.19 61.47 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 121.518 -0.989 . . . . 0.0 112.89 -172.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.6 tt -65.35 -15.86 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.516 1.126 . . . . 0.0 113.333 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.9 -50.12 19.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.736 1.214 . . . . 0.0 111.076 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.28 -19.56 71.61 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.634 -0.666 . . . . 0.0 113.228 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.3 -50.89 23.54 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.721 1.261 . . . . 0.0 108.307 169.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -63.09 -48.49 78.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.4 0.68 . . . . 0.0 110.252 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 30.3 mt -60.37 -27.74 67.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.031 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -68.2 -55.59 11.72 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.57 0.623 . . . . 0.0 109.61 171.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.89 69.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.671 1.189 . . . . 0.0 112.46 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.6 mt -65.58 -3.37 4.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.854 0.862 . . . . 0.0 113.215 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 65.9 p -102.42 11.65 37.69 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.519 1.054 . . . . 0.0 111.822 169.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -135.69 43.77 2.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.793 1.637 . . . . 0.0 110.656 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.97 91.33 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 O-C-N 119.478 -2.014 . . . . 0.0 105.72 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.84 -27.83 24.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 168.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.19 165.84 28.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.389 2.676 . . . . 0.0 114.016 -172.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 12.1 t -161.0 163.62 31.57 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.994 1.318 . . . . 0.0 108.792 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.62 92.24 0.2 Allowed Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 108.394 -1.883 . . . . 0.0 108.394 172.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 93.0 t -80.73 125.22 39.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 119.412 1.606 . . . . 0.0 108.774 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.74 85.7 2.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.656 1.582 . . . . 0.0 107.933 -174.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -11.88 59.92 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.927 1.291 . . . . 0.0 113.74 -175.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.85 138.4 42.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.904 1.281 . . . . 0.0 109.01 160.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 150.87 97.55 Favored Pre-proline 0 N--CA 1.445 -0.692 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 164.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.28 119.73 4.5 Favored 'Cis proline' 0 N--CA 1.456 -0.721 0 N-CA-C 109.087 -1.159 . . . . 0.0 109.087 -12.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -62.59 132.01 50.94 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.566 0.747 . . . . 0.0 110.857 -167.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -143.1 170.9 14.85 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.182 1.393 . . . . 0.0 109.8 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 42.5 ttp -139.88 118.28 12.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.071 1.348 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -79.18 150.71 31.61 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 158.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 96.3 mt -116.78 147.78 41.77 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 153.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.76 131.07 73.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 10.9 mp -78.68 160.53 27.45 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -48.67 -36.63 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.877 -1.511 . . . . 0.0 112.38 171.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.49 -14.43 58.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.799 0.84 . . . . 0.0 110.27 -173.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 109.64 0.77 30.73 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.352 0.977 . . . . 0.0 114.183 -174.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.46 153.39 35.56 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.99 1.395 . . . . 0.0 109.563 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.5 m -132.25 104.5 6.79 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.754 -0.591 . . . . 0.0 109.925 -167.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -104.91 150.98 24.42 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 46.5 m -141.76 123.96 15.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.058 0.943 . . . . 0.0 109.716 -167.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -122.41 139.49 53.78 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.69 1.596 . . . . 0.0 109.438 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.22 147.34 29.01 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.447 1.499 . . . . 0.0 108.536 168.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 101.24 6.62 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 120.671 -1.268 . . . . 0.0 109.457 168.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' SER . . . . . 0.405 ' H ' ' HA ' ' A' ' 28' ' ' TRP . 42.3 t -84.48 118.36 24.25 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 148.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.0 m -138.53 65.19 1.47 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.353 1.861 . . . . 0.0 106.462 152.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 126.853 2.061 . . . . 0.0 107.285 168.074 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.547 0.213 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -150.17 144.5 17.61 Favored Pre-proline 0 N--CA 1.435 -1.177 0 O-C-N 120.35 -1.469 . . . . 0.0 111.382 177.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.04 -41.0 10.56 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.825 2.35 . . . . 0.0 110.73 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.03 22.21 0.11 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.911 1.284 . . . . 0.0 112.289 175.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 -27.35 12.63 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 119.626 1.103 . . . . 0.0 111.832 160.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.0 m -70.91 -21.75 62.33 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.018 1.327 . . . . 0.0 112.998 -171.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -22.15 4.37 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.443 1.897 . . . . 0.0 113.445 165.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 mt -107.19 50.65 0.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.561 -171.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.3 mt -121.66 21.65 10.77 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.238 1.415 . . . . 0.0 110.27 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.39 -11.12 41.47 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.237 -0.915 . . . . 0.0 112.356 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -128.79 -6.63 5.07 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -83.06 -177.78 6.88 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.608 1.163 . . . . 0.0 112.833 -166.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -136.83 -64.87 0.57 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.056 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 66.28 162.5 0.16 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.012 1.725 . . . . 0.0 113.581 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.4 t -139.82 146.93 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -97.06 133.45 41.71 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.65 -3.76 1.85 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.61 149.81 27.03 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.925 1.239 . . . . 0.0 112.171 166.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -137.55 132.67 33.51 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.328 2.651 . . . . 0.0 108.154 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.33 147.15 46.06 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.124 1.769 . . . . 0.0 109.405 174.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -90.85 178.13 6.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.901 0.319 . . . . 0.0 110.301 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.52 69.35 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.966 0.506 . . . . 0.0 112.318 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -100.2 18.95 17.42 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.052 0.454 . . . . 0.0 110.793 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.6 8.83 79.74 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.018 -1.676 . . . . 0.0 112.268 170.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -66.41 100.98 0.69 Allowed 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 125.728 1.611 . . . . 0.0 108.181 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.4 106.11 1.64 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.457 1.026 . . . . 0.0 109.882 168.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -64.7 156.06 31.54 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.572 0.749 . . . . 0.0 110.183 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 142.46 54.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 167.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.5 m -144.23 159.52 52.06 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 125.656 1.583 . . . . 0.0 108.039 168.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -75.21 115.1 4.16 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.998 2.465 . . . . 0.0 110.435 171.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 166.83 12.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.49 1.916 . . . . 0.0 109.34 166.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.25 -52.42 65.67 Favored 'General case' 0 C--O 1.23 0.07 0 O-C-N 121.87 -0.519 . . . . 0.0 111.44 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -8.4 26.17 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.33 -15.41 50.14 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 120.892 -1.13 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.66 -81.27 0.27 Allowed Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.45 85.48 7.21 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 125.497 1.519 . . . . 0.0 107.998 -174.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -67.73 164.07 32.77 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.829 2.353 . . . . 0.0 110.443 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.463 HG12 ' H ' ' A' ' 70' ' ' GLY . 41.0 mt -79.85 107.03 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.3 p -113.43 129.95 56.42 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.3 tp -95.43 155.34 16.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.783 1.633 . . . . 0.0 106.598 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m -144.76 118.52 9.25 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.8 mt -117.12 85.59 2.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 -174.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.38 172.45 12.93 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.799 0.84 . . . . 0.0 110.231 -172.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.0 p -103.1 24.58 10.61 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.664 1.586 . . . . 0.0 112.873 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.94 -47.09 52.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.701 1.591 . . . . 0.0 112.616 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -74.6 3.03 8.43 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 118.995 0.816 . . . . 0.0 112.995 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.92 -27.36 20.78 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 127.388 2.423 . . . . 0.0 111.829 -171.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -120.27 152.7 37.4 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 118.316 1.058 . . . . 0.0 111.16 -172.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.1 ptp85 -65.6 96.88 0.28 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.59 154.27 49.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.242 1.017 . . . . 0.0 109.204 170.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.55 111.75 23.51 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.947 -1.871 . . . . 0.0 105.947 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.1 p -124.58 86.61 2.59 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.139 1.376 . . . . 0.0 108.354 -169.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 168.13 24.91 Favored Glycine 0 N--CA 1.469 0.873 0 O-C-N 120.994 -1.066 . . . . 0.0 111.514 -163.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -95.31 102.43 14.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 123.846 0.858 . . . . 0.0 109.752 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 p -93.28 99.27 11.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 119.161 0.891 . . . . 0.0 109.001 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.463 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 75.07 -70.36 1.82 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 124.497 1.046 . . . . 0.0 112.784 166.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 28.3 t -130.94 -14.27 3.51 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.858 1.263 . . . . 0.0 112.797 175.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.499 ' ND2' ' H ' ' A' ' 95' ' ' MET . 7.2 m120 -133.87 133.79 41.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -165.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -71.18 138.26 49.41 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 118.29 -1.364 . . . . 0.0 109.273 170.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -103.17 162.89 12.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.969 2.043 . . . . 0.0 109.409 168.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.96 161.61 41.97 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.752 2.021 . . . . 0.0 107.232 167.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -171.92 -108.92 0.22 Allowed Glycine 0 C--N 1.334 0.456 0 O-C-N 121.927 -0.483 . . . . 0.0 112.373 169.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.0 m -154.37 168.71 25.72 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 127.278 2.231 . . . . 0.0 106.795 166.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -142.48 171.56 13.89 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.088 0.555 . . . . 0.0 110.184 162.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -146.58 152.17 38.5 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.34 1.856 . . . . 0.0 107.868 170.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.8 128.39 45.9 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 172.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -164.23 164.36 22.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 125.732 1.613 . . . . 0.0 108.639 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.88 4.88 2.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.33 6.08 89.43 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 118.576 -1.124 . . . . 0.0 112.316 -166.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.4 pttp -123.24 168.27 12.66 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 126.34 1.856 . . . . 0.0 110.846 -173.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.64 135.45 35.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 169.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.29 131.48 55.76 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 165.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.97 161.32 13.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 171.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.09 -147.9 16.83 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -57.59 99.99 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.532 0.733 . . . . 0.0 109.049 167.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -98.24 142.8 29.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.069 1.348 . . . . 0.0 108.599 170.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.15 -177.01 48.32 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.08 -168.55 32.11 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -172.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.9 p -75.61 173.32 11.2 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.988 2.515 . . . . 0.0 112.468 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -122.02 84.2 2.22 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 126.12 1.768 . . . . 0.0 108.899 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.499 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 11.0 mtt -73.68 -174.48 1.77 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.21 1.404 . . . . 0.0 108.155 159.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -142.63 109.77 5.59 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 120.824 1.647 . . . . 0.0 111.658 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 68.2 m -93.98 -14.79 25.52 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.764 -1.112 . . . . 0.0 112.442 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp 47.34 28.12 1.01 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.973 1.709 . . . . 0.0 114.824 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -117.57 164.33 19.94 Favored Pre-proline 0 C--O 1.239 0.513 0 C-N-CA 126.432 1.893 . . . . 0.0 109.936 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.92 -14.85 26.5 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.244 1.963 . . . . 0.0 113.788 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.31 -2.26 74.01 Favored Glycine 0 C--O 1.222 -0.604 0 CA-C-O 117.675 -1.625 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.75 -58.62 1.59 Allowed Glycine 0 C--N 1.337 0.587 0 CA-C-N 119.958 1.879 . . . . 0.0 112.803 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.07 -3.59 20.6 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -173.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -65.15 -10.48 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.135 0.974 . . . . 0.0 112.317 171.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -44.61 -60.68 1.87 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.265 1.426 . . . . 0.0 110.68 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.85 -30.11 77.1 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 118.501 -1.166 . . . . 0.0 112.333 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.45 -43.91 76.04 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.306 1.553 . . . . 0.0 109.845 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.72 -49.01 74.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.999 0.92 . . . . 0.0 109.758 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.39 -36.03 75.05 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.465 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -51.95 61.99 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.191 0.996 . . . . 0.0 110.123 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.79 -30.46 68.0 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.534 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.45 -22.11 65.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.379 1.472 . . . . 0.0 112.527 177.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.0 p -73.08 -27.51 61.76 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.544 -0.722 . . . . 0.0 111.157 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -114.96 49.57 1.04 Allowed 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 126.26 1.824 . . . . 0.0 110.05 -165.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.5 mm -75.41 69.15 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 166.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.64 -32.7 60.32 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 120.818 -1.176 . . . . 0.0 109.286 177.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -133.67 160.18 38.31 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.554 1.542 . . . . 0.0 110.366 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -155.47 166.5 33.35 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.131 -0.981 . . . . 0.0 109.886 -162.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.55 76.1 0.09 OUTLIER Glycine 0 CA--C 1.531 1.069 0 CA-C-N 118.61 0.641 . . . . 0.0 113.131 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . 0.255 5.2 p -86.17 127.17 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.173 -1.781 . . . . 0.0 110.314 171.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -99.58 80.71 2.4 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.367 1.467 . . . . 0.0 107.041 173.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.406 ' HG3' HE21 ' A' ' 126' ' ' GLN . 27.8 ttm -82.18 63.38 6.36 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.843 1.656 . . . . 0.0 110.966 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -139.32 130.01 25.98 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 165.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.45 137.16 16.69 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 168.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.61 122.06 7.12 Favored 'Cis proline' 0 CA--C 1.542 0.876 0 CA-C-N 119.419 0.828 . . . . 0.0 111.383 -6.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . 0.406 HE21 ' HG3' ' A' ' 122' ' ' MET . 58.6 mt-30 -75.7 135.77 40.38 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.376 1.07 . . . . 0.0 110.93 -169.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -146.19 176.19 9.93 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 125.972 1.709 . . . . 0.0 108.839 165.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -141.7 134.09 28.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.076 1.75 . . . . 0.0 108.027 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -112.22 155.25 24.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 126.611 1.964 . . . . 0.0 109.329 172.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 138' ' ' LEU 0.266 0.0 OUTLIER -138.78 155.39 48.22 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 127.127 2.171 . . . . 0.0 109.904 162.526 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.5 t -134.06 136.59 53.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 177.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -88.2 174.26 8.32 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 122.154 0.978 . . . . 0.0 111.287 -174.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -54.41 -39.71 67.55 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.619 1.968 . . . . 0.0 111.882 163.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -84.23 -20.81 31.64 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 126.491 1.916 . . . . 0.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 95.87 20.82 25.17 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-O 118.837 -0.98 . . . . 0.0 114.369 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.82 155.91 3.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.032 1.416 . . . . 0.0 108.729 163.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.06 110.55 11.71 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 126.037 1.735 . . . . 0.0 106.676 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.413 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 0.5 OUTLIER -116.61 150.38 38.17 Favored 'General case' 0 CA--C 1.515 -0.366 0 O-C-N 121.451 -0.781 . . . . 0.0 109.239 -172.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 38.7 m -138.4 103.79 4.99 Favored 'General case' 0 C--O 1.239 0.541 0 O-C-N 124.277 0.986 . . . . 0.0 111.419 -162.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -92.59 168.8 10.99 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.707 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.39 143.58 47.37 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 126.573 1.949 . . . . 0.0 107.698 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -75.76 104.02 6.12 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.539 -1.351 . . . . 0.0 108.978 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 2.6 t -99.3 115.84 30.09 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 150.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 p -128.06 1.1 5.89 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.87 1.268 . . . . 0.0 112.629 156.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 C--O 1.258 1.547 0 C-N-CA 131.239 3.815 . . . . 0.0 104.164 -167.54 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 121.788 0.804 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 156.98 45.37 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 123.698 0.799 . . . . 0.0 111.627 -176.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.89 -38.0 31.77 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.898 3.065 . . . . 0.0 112.883 176.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.8 19.61 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.449 2.3 . . . . 0.0 115.468 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.84 -8.64 1.39 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.46 1.504 . . . . 0.0 113.261 -170.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.5 m -79.53 -19.37 49.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.971 1.26 . . . . 0.0 112.801 175.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -57.03 -19.23 17.57 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.124 1.329 . . . . 0.0 113.702 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 3.84 51.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.72 0.691 . . . . 0.0 110.388 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -84.99 66.19 9.63 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.492 1.042 . . . . 0.0 110.633 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -120.48 -48.35 2.3 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 124.125 0.97 . . . . 0.0 112.502 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -127.95 57.8 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.2 p -139.98 160.89 38.9 Favored 'General case' 0 C--N 1.337 0.055 0 CA-C-O 122.084 0.945 . . . . 0.0 110.63 -173.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.595 ' H ' ' NH1' ' A' ' 142' ' ' ARG . 3.2 p -142.49 136.43 29.38 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 124.123 0.969 . . . . 0.0 109.008 -158.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 47.8 m95 -149.97 165.22 33.31 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.855 0.722 . . . . 0.0 109.901 -165.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 70.4 t -142.01 123.53 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.52 130.84 45.21 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.55 -6.08 2.54 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.552 0.533 . . . . 0.0 111.918 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.9 162.13 36.87 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.019 -1.051 . . . . 0.0 110.918 169.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -145.76 116.69 7.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.63 138.72 38.24 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 174.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -71.28 167.27 19.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 118.574 0.625 . . . . 0.0 109.344 167.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.4 -30.16 70.38 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.18 0.592 . . . . 0.0 112.393 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -74.86 -45.07 45.49 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.69 3.47 1.78 Allowed Glycine 0 CA--C 1.531 1.035 0 CA-C-O 119.118 -0.823 . . . . 0.0 113.792 -172.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.6 m -65.04 101.63 0.53 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.377 2.089 . . . . 0.0 108.379 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.86 108.41 0.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.028 -1.045 . . . . 0.0 109.398 165.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -66.65 161.83 22.47 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.098 0.959 . . . . 0.0 110.446 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.38 145.34 39.48 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 158.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 m -140.49 165.42 30.22 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.424 1.89 . . . . 0.0 107.561 168.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.97 127.44 13.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 CA-C-N 120.556 1.234 . . . . 0.0 110.884 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.77 162.44 16.04 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.819 1.248 . . . . 0.0 112.002 164.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.15 -36.63 61.06 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.497 -0.752 . . . . 0.0 110.443 164.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.9 -21.06 60.21 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.936 0.895 . . . . 0.0 112.957 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -70.36 -11.86 61.2 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.574 -0.704 . . . . 0.0 112.523 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.1 -1.63 38.05 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 118.437 -1.202 . . . . 0.0 113.389 175.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -169.6 83.6 0.62 Allowed Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.844 1.258 . . . . 0.0 111.064 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.6 157.09 63.27 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 121.97 1.78 . . . . 0.0 110.357 171.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 32.2 mt -87.25 111.55 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.1 p -123.37 132.29 53.93 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -169.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.1 tp -111.58 134.5 53.11 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 124.993 1.317 . . . . 0.0 108.527 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.1 m -124.14 140.65 52.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 167.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.4 mt -123.3 121.56 36.15 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.9 t -172.67 -174.26 1.12 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.2 p -113.5 36.05 3.76 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.067 1.347 . . . . 0.0 112.545 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.8 m -49.12 -14.63 0.08 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 170.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -113.07 3.12 15.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.295 1.407 . . . . 0.0 111.096 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.02 -13.23 39.13 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 119.902 1.228 . . . . 0.0 111.692 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -113.67 166.07 11.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 121.232 -1.157 . . . . 0.0 110.422 164.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -55.47 115.78 2.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.642 1.177 . . . . 0.0 110.046 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.96 168.86 19.25 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.273 1.029 . . . . 0.0 108.403 176.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.13 73.47 1.45 Allowed 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.443 1.097 . . . . 0.0 109.12 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 t -68.98 116.42 9.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.73 175.84 25.03 Favored Glycine 0 C--N 1.328 0.087 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -167.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.56 106.87 9.04 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.3 m -78.05 -177.14 4.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.126 0.971 . . . . 0.0 108.796 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.98 -30.5 1.75 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 126.277 1.894 . . . . 0.0 117.324 -163.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.8 OUTLIER -147.58 6.88 0.84 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 119.403 1.601 . . . . 0.0 114.502 156.282 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -134.05 122.29 22.75 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -160.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -69.12 146.78 52.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.232 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -130.58 166.15 21.23 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 126.238 1.815 . . . . 0.0 109.422 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.1 ptp -154.7 163.21 40.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.448 1.899 . . . . 0.0 108.066 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 154.41 172.04 21.9 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 46.1 p -94.6 153.74 17.7 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.156 1.382 . . . . 0.0 111.589 -170.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -108.99 166.29 10.94 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.497 0.665 . . . . 0.0 110.764 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.11 122.2 7.7 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.112 1.365 . . . . 0.0 107.862 177.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.1 mt -101.47 111.84 24.2 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.565 1.546 . . . . 0.0 107.876 -172.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -154.52 163.53 40.06 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.171 1.788 . . . . 0.0 108.807 -175.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.7 29.24 2.11 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.694 2.398 . . . . 0.0 116.953 163.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.16 11.73 71.1 Favored Glycine 0 CA--C 1.533 1.196 0 O-C-N 120.85 -1.156 . . . . 0.0 113.228 -174.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -129.6 165.65 21.32 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.737 2.415 . . . . 0.0 112.242 -170.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.89 92.07 3.63 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.5 t -86.69 167.14 14.76 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -129.44 173.56 10.44 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.413 1.085 . . . . 0.0 110.702 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -106.34 -136.75 8.46 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 127.783 2.611 . . . . 0.0 108.942 170.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.9 m -64.42 83.65 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.771 1.629 . . . . 0.0 111.546 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.0 mt -77.02 143.33 39.43 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 120.848 -1.157 . . . . 0.0 108.929 169.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.83 -176.63 46.33 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.68 -141.66 3.27 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.518 0.659 . . . . 0.0 112.347 -159.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.7 t -115.53 168.22 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 169.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -126.71 90.8 3.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 171.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtm -102.68 172.85 6.61 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.78 107.12 8.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.542 1.519 . . . . 0.0 111.796 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.7 m -79.22 -7.18 58.05 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.183 0.993 . . . . 0.0 113.544 170.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 66.51 20.79 10.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.235 1.814 . . . . 0.0 113.227 176.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 p -127.03 161.31 54.58 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.099 1.76 . . . . 0.0 110.978 -170.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -37.4 5.68 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.37 2.047 . . . . 0.0 111.034 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.49 -30.5 75.11 Favored Glycine 0 C--O 1.22 -0.753 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.361 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -60.8 8.3 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.116 1.458 . . . . 0.0 109.889 167.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -81.82 1.86 32.82 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -164.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tt -78.99 -7.73 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.195 -0.941 . . . . 0.0 110.43 166.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.46 -59.28 2.5 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.689 1.596 . . . . 0.0 111.842 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.84 87.93 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 119.155 -0.803 . . . . 0.0 111.213 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.19 84.39 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 118.267 1.034 . . . . 0.0 109.985 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -64.38 -43.76 93.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.464 -0.779 . . . . 0.0 109.942 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.3 -38.02 76.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.885 1.221 . . . . 0.0 110.011 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -19.21 65.86 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.211 1.005 . . . . 0.0 113.631 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.6 -25.16 23.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.687 0.795 . . . . 0.0 110.681 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.78 11.62 3.77 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.908 1.283 . . . . 0.0 113.126 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.86 -5.99 15.36 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 125.667 1.587 . . . . 0.0 111.306 164.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -126.31 66.66 1.22 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.684 1.194 . . . . 0.0 108.415 -172.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.31 31.56 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 120.959 -1.088 . . . . 0.0 110.592 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -54.42 -29.06 48.0 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.232 -1.542 . . . . 0.0 113.435 -168.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -125.79 163.67 22.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.449 1.5 . . . . 0.0 110.02 170.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 93.6 m -157.97 165.81 34.18 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.355 1.462 . . . . 0.0 107.104 176.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -161.88 127.42 1.72 Allowed Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 169.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.74 142.35 16.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 118.874 1.337 . . . . 0.0 108.097 171.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.86 75.58 2.39 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 172.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.9 ttm -77.25 73.52 3.83 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.8 1.24 . . . . 0.0 107.757 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.5 140.22 12.37 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 171.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.2 132.19 95.01 Favored Pre-proline 0 N--CA 1.446 -0.674 0 N-CA-C 108.031 -1.099 . . . . 0.0 108.031 173.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -78.49 120.63 7.36 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 CA-C-N 119.925 1.009 . . . . 0.0 111.647 -1.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.67 131.18 45.11 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.56 0.695 . . . . 0.0 110.981 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -146.11 164.08 33.31 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.615 1.566 . . . . 0.0 106.948 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -138.48 147.96 43.8 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 125.842 1.657 . . . . 0.0 107.26 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -130.11 141.99 50.64 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 166.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.36 161.33 14.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 160.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.0 t -136.07 121.42 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.06 170.4 11.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.236 0.541 . . . . 0.0 111.158 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 46.1 p-10 -64.52 -26.11 68.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.481 169.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.58 -37.41 62.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 119.703 1.138 . . . . 0.0 108.848 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.53 10.92 9.94 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.373 -173.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -55.65 151.02 11.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 120.332 2.066 . . . . 0.0 108.628 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.6 m -130.41 96.67 4.2 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.802 0.841 . . . . 0.0 109.065 -175.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.04 133.07 36.82 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.623 1.169 . . . . 0.0 107.867 169.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.9 m -108.65 128.62 55.01 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.438 1.095 . . . . 0.0 109.431 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.87 131.07 54.19 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.725 1.21 . . . . 0.0 109.311 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.43 148.12 26.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.823 1.249 . . . . 0.0 109.62 172.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.595 ' NH1' ' H ' ' A' ' 27' ' ' SER . 34.0 tpt85 -70.26 132.94 46.48 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.737 -1.125 . . . . 0.0 108.423 173.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -133.87 60.91 1.69 Allowed 'General case' 0 C--N 1.347 0.47 0 CA-C-N 120.338 1.426 . . . . 0.0 110.517 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 3.77 7.92 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 ttm-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.195 1.398 . . . . 0.0 112.97 -169.804 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 CA--C 1.53 0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.82 144.45 89.94 Favored Pre-proline 0 N--CA 1.469 0.502 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.917 -177.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.53 -14.74 30.73 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 123.38 2.72 . . . . 0.0 112.528 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.64 31.9 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.405 1.882 . . . . 0.0 112.169 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -131.64 -28.3 1.84 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.741 -1.225 . . . . 0.0 112.213 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.5 m -67.26 -17.23 64.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.994 0.815 . . . . 0.0 110.978 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -59.47 -11.26 4.22 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.961 1.304 . . . . 0.0 114.186 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.1 mt -106.6 7.72 30.85 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.526 1.53 . . . . 0.0 111.581 -172.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.37 51.8 0.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.121 1.368 . . . . 0.0 110.816 -172.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.45 0.95 0.81 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -165.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.0 -7.95 12.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.684 0.793 . . . . 0.0 111.451 148.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 80.8 p -73.83 -176.7 2.53 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.956 0.884 . . . . 0.0 112.047 -155.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -149.52 -68.42 0.21 Allowed 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.114 -2.241 . . . . 0.0 110.61 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.6 m95 69.78 163.44 0.24 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.822 1.249 . . . . 0.0 112.841 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.4 t -143.51 119.55 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.58 136.69 57.72 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.38 -11.51 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.95 151.37 28.44 Favored 'General case' 0 CA--C 1.515 -0.392 0 O-C-N 120.415 -1.428 . . . . 0.0 109.39 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -132.34 107.46 8.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -91.72 140.7 29.46 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -68.84 163.84 23.33 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.589 0.756 . . . . 0.0 110.372 166.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.52 69.82 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.708 0.803 . . . . 0.0 112.337 171.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -77.84 -21.22 51.8 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.502 0.592 . . . . 0.0 112.091 177.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.72 6.07 23.45 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.735 1.159 . . . . 0.0 114.669 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -68.28 115.41 7.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.877 2.071 . . . . 0.0 108.592 171.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.59 107.32 4.4 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.787 -1.196 . . . . 0.0 110.423 167.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.0 mtt180 -65.6 149.28 50.34 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.716 0.806 . . . . 0.0 110.18 173.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.97 139.59 58.78 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.104 0.562 . . . . 0.0 109.724 166.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -139.12 160.86 60.72 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 127.45 2.3 . . . . 0.0 108.574 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.78 116.06 4.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.532 2.155 . . . . 0.0 110.822 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.63 168.52 17.51 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.865 0.84 . . . . 0.0 111.597 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.26 -38.91 81.27 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.826 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -87.93 15.85 6.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.292 1.437 . . . . 0.0 111.597 176.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -105.76 -27.6 11.18 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.471 161.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.93 -27.33 3.67 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 123.545 0.593 . . . . 0.0 114.364 157.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -136.34 73.04 57.73 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 125.049 1.34 . . . . 0.0 110.101 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.11 143.54 78.56 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.858 1.705 . . . . 0.0 108.118 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 83.9 mt -70.83 99.56 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 125.526 1.53 . . . . 0.0 109.27 -169.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -87.41 149.85 24.19 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 126.544 1.938 . . . . 0.0 107.778 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 21.3 tp -127.87 157.8 39.52 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.299 1.44 . . . . 0.0 107.906 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.62 108.32 4.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.42 108.85 19.88 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 169.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 t -149.68 174.69 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.04 35.22 4.82 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.079 0.952 . . . . 0.0 109.924 171.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.2 t -48.35 -52.54 21.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.112 0.965 . . . . 0.0 110.224 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.5 t -84.52 10.23 11.48 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.656 1.182 . . . . 0.0 111.778 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.85 -38.63 2.82 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 127.016 2.246 . . . . 0.0 111.476 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -73.43 150.29 41.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 173.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -72.25 98.47 2.18 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 167.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.44 152.84 45.85 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 122.438 1.113 . . . . 0.0 110.375 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.93 133.37 41.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 153.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 53.5 p -116.24 172.0 7.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 141.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.93 175.1 39.27 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -109.64 94.62 5.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.6 m -73.56 80.21 1.47 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.697 0.761 . . . . 0.0 109.643 175.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.18 -51.57 4.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 124.388 0.994 . . . . 0.0 112.695 155.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -152.48 14.18 0.57 Allowed 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.924 -0.751 . . . . 0.0 111.873 153.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.7 110.32 6.71 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.775 -1.203 . . . . 0.0 108.304 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 136.06 40.45 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.957 1.703 . . . . 0.0 113.981 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -112.03 168.33 9.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 126.243 1.817 . . . . 0.0 110.788 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -152.73 156.72 39.69 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.142 1.777 . . . . 0.0 107.338 166.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -170.37 -109.29 0.22 Allowed Glycine 0 CA--C 1.525 0.711 0 O-C-N 121.622 -0.674 . . . . 0.0 111.883 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.6 168.88 22.69 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.405 1.482 . . . . 0.0 107.917 174.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -152.12 169.39 22.52 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.639 1.176 . . . . 0.0 110.661 170.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.18 157.15 42.3 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.77 1.628 . . . . 0.0 109.451 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.26 138.81 47.25 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.253 1.021 . . . . 0.0 108.834 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -162.31 164.69 27.36 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.922 2.089 . . . . 0.0 108.321 167.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.5 t0 51.67 32.83 9.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 162.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.34 29.43 63.21 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.197 -0.94 . . . . 0.0 113.332 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -128.54 154.79 45.78 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 128.173 2.589 . . . . 0.0 110.93 -175.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -114.48 99.52 7.62 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -100.85 153.22 19.67 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 -175.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -115.52 161.68 18.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.008 0.909 . . . . 0.0 110.087 -171.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.51 -168.09 37.9 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 108.693 -1.763 . . . . 0.0 108.693 159.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.85 149.97 34.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 165.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.8 mt -126.16 171.73 10.63 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.574 1.55 . . . . 0.0 110.568 -170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.78 175.99 37.42 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 124.034 0.826 . . . . 0.0 111.081 164.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -159.43 -115.77 0.42 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.0 t -115.12 -175.1 2.62 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 129.793 3.237 . . . . 0.0 109.872 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.2 mmt180 -141.98 56.05 1.48 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.465 1.906 . . . . 0.0 108.337 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.97 159.01 31.53 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.265 -0.897 . . . . 0.0 109.753 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.9 112.18 23.84 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.989 1.316 . . . . 0.0 110.305 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.1 m -117.49 -9.34 10.86 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -176.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 55.7 mtm 61.03 22.37 12.63 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.148 0.979 . . . . 0.0 112.844 171.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.3 p -114.18 154.43 46.24 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 126.303 1.841 . . . . 0.0 108.988 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.57 -40.95 21.31 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 120.891 1.061 . . . . 0.0 109.522 170.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -70.54 -5.62 56.25 Favored Glycine 0 C--O 1.22 -0.742 0 CA-C-O 116.824 -2.098 . . . . 0.0 113.841 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.25 -57.88 3.3 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 120.933 2.367 . . . . 0.0 109.784 168.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.36 -15.88 63.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.05 0.94 . . . . 0.0 111.846 -167.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.53 -6.13 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.716 0.806 . . . . 0.0 111.68 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -44.26 -52.57 7.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.706 1.139 . . . . 0.0 110.44 165.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -60.77 -46.36 94.65 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 119.934 -0.37 . . . . 0.0 112.498 -173.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.47 85.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.188 0.494 . . . . 0.0 109.81 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -68.64 -47.06 67.55 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.228 -0.92 . . . . 0.0 111.016 -173.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.01 -29.32 68.4 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.763 0.71 . . . . 0.0 111.017 173.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -42.02 90.91 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.084 0.554 . . . . 0.0 111.293 171.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.35 65.22 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.651 0.78 . . . . 0.0 112.111 -173.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.83 -12.52 61.32 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.781 169.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 12.1 p -93.78 13.96 20.79 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.547 1.521 . . . . 0.0 112.311 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -141.11 28.72 1.87 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.53 1.059 . . . . 0.0 111.804 -171.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.9 mm -71.56 80.57 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 125.441 1.497 . . . . 0.0 107.447 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -80.27 -34.67 36.84 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 165.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -125.4 164.04 21.29 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.101 0.96 . . . . 0.0 110.576 -176.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 53.7 m -160.87 145.28 13.82 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.04 91.78 0.15 Allowed Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 108.229 -1.949 . . . . 0.0 108.229 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . 0.266 4.5 p -87.59 132.46 32.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.389 1.094 . . . . 0.0 110.091 165.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -98.42 88.52 4.15 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 166.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 51.8 tpp -82.67 57.48 3.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 174.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -145.08 116.51 8.04 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.27 125.48 14.97 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-O 117.297 -1.335 . . . . 0.0 109.517 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 115.2 3.41 Favored 'Cis proline' 0 CA--C 1.538 0.691 0 O-C-N 122.933 0.965 . . . . 0.0 112.706 5.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -78.82 129.71 34.89 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -167.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.67 160.29 41.44 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.443 1.497 . . . . 0.0 108.424 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 46.6 ttp -134.09 127.11 31.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -123.61 109.72 14.11 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.813 0.845 . . . . 0.0 108.737 -174.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 16.3 mt -94.04 143.49 26.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -131.85 136.29 57.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.2 mp -95.33 171.27 8.81 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.625 0.726 . . . . 0.0 110.497 -174.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -53.31 -27.47 23.3 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 112.621 168.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -90.66 -16.56 28.38 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.193 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 105.99 8.35 34.25 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.693 -1.615 . . . . 0.0 115.607 177.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.18 165.45 0.09 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 120.063 1.931 . . . . 0.0 110.842 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.3 m -142.11 95.86 2.87 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 120.243 -1.536 . . . . 0.0 109.67 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.0 mp -86.92 146.72 26.06 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.156 -0.965 . . . . 0.0 108.68 173.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.4 m -125.46 125.23 43.0 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.94 1.296 . . . . 0.0 109.038 -176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -123.07 135.01 54.23 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.322 1.049 . . . . 0.0 110.084 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -81.54 147.51 29.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.912 1.285 . . . . 0.0 108.338 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.8 tpt85 -76.26 100.42 5.08 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.694 -1.254 . . . . 0.0 108.94 165.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 20.7 t -75.76 127.65 33.48 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 146.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -131.47 17.2 4.88 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.455 1.902 . . . . 0.0 112.853 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 . . . . . 0 C--O 1.251 1.181 0 CA-C-N 118.872 0.76 . . . . 0.0 110.065 170.145 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.2 144.27 31.87 Favored Pre-proline 0 N--CA 1.472 0.66 0 C-N-CA 124.533 1.133 . . . . 0.0 111.158 -174.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -84.8 -18.51 4.47 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 124.215 3.277 . . . . 0.0 112.577 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.81 -10.36 8.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.992 0.917 . . . . 0.0 113.022 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -101.38 -2.37 31.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.409 2.284 . . . . 0.0 112.611 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.1 m -60.69 -57.21 13.67 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.098 1.317 . . . . 0.0 111.598 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.68 -18.14 0.65 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -80.78 5.25 16.42 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.125 1.37 . . . . 0.0 111.262 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.6 61.71 3.74 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 119.546 -1.971 . . . . 0.0 111.575 -173.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.24 -52.35 1.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 118.764 0.711 . . . . 0.0 112.646 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.0 -4.79 57.24 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.919 0.781 . . . . 0.0 111.79 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.5 -177.1 2.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.487 1.115 . . . . 0.0 111.499 -173.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.3 m -142.95 -57.73 0.43 Allowed 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.082 -1.636 . . . . 0.0 112.845 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 9.0 m95 69.83 165.68 0.27 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.342 1.857 . . . . 0.0 112.293 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -143.14 137.69 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -79.5 132.06 36.22 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 175.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.3 t -126.24 -17.05 5.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.38 158.35 34.08 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.653 1.115 . . . . 0.0 111.097 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -139.06 95.04 2.88 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.737 1.615 . . . . 0.0 108.672 -176.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.95 146.16 46.25 Favored 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 121.441 -0.787 . . . . 0.0 110.439 174.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.446 ' C ' ' H ' ' A' ' 37' ' ' ASP . 28.3 mt-30 -80.23 166.49 21.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.096 1.358 . . . . 0.0 109.645 166.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.29 14.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.84 2.056 . . . . 0.0 113.497 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.446 ' H ' ' C ' ' A' ' 35' ' ' GLN . 26.0 t0 -137.13 4.61 2.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.154 1.782 . . . . 0.0 111.94 177.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.94 -5.0 78.93 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.357 -1.464 . . . . 0.0 112.961 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.3 m -68.94 108.41 3.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.659 1.584 . . . . 0.0 108.971 171.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.74 129.82 41.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.007 -1.058 . . . . 0.0 109.957 163.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.3 mtt85 -77.86 172.69 13.08 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.827 1.651 . . . . 0.0 110.71 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.42 136.18 33.96 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 162.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.71 157.59 77.94 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.289 1.836 . . . . 0.0 108.486 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.86 123.9 9.72 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.753 1.635 . . . . 0.0 109.739 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -78.51 172.05 14.22 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 164.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -51.65 62.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.095 0.958 . . . . 0.0 111.911 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -67.31 -14.42 62.9 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -68.96 -15.75 63.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.749 1.159 . . . . 0.0 110.884 174.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.94 -30.76 3.65 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 123.343 0.497 . . . . 0.0 112.876 160.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.65 85.13 4.91 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -174.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -73.76 160.81 43.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.999 2.466 . . . . 0.0 112.708 -176.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.467 HG12 ' H ' ' A' ' 70' ' ' GLY . 16.5 mt -85.7 101.05 9.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.479 1.111 . . . . 0.0 108.772 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -121.54 119.16 31.14 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -79.31 164.94 23.68 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 175.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.2 m -149.82 111.71 4.57 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 119.918 -1.739 . . . . 0.0 108.34 167.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.13 147.22 29.17 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 164.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.6 t -165.4 158.22 15.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.8 p -130.88 29.36 4.74 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.567 -0.708 . . . . 0.0 110.089 167.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -53.76 -44.96 70.44 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.01 0.924 . . . . 0.0 112.018 -170.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -14.09 62.77 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.623 0.769 . . . . 0.0 112.623 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.2 2.26 55.81 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 125.497 1.522 . . . . 0.0 112.902 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.0 174.48 6.18 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.492 1.646 . . . . 0.0 108.967 164.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.406 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 26.8 mtp85 -82.21 63.07 6.23 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 125.871 1.668 . . . . 0.0 109.176 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.35 157.99 30.35 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 162.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.31 156.32 43.23 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 149.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 p -126.84 171.72 11.01 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 166.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.97 178.71 44.11 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.339 -1.504 . . . . 0.0 109.339 168.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -111.87 129.73 56.06 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 p -130.21 118.52 21.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.328 1.451 . . . . 0.0 109.3 -176.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.467 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 57.45 -78.83 0.01 OUTLIER Glycine 0 CA--C 1.526 0.778 0 C-N-CA 126.826 2.155 . . . . 0.0 112.052 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.0 OUTLIER -138.67 0.32 2.01 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 170.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -117.13 139.11 51.15 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 119.867 1.212 . . . . 0.0 109.587 175.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -70.75 154.93 41.39 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.57 -0.452 . . . . 0.0 109.889 161.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -138.15 164.96 27.85 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.399 1.479 . . . . 0.0 109.393 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -156.0 163.97 39.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.522 1.529 . . . . 0.0 108.469 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.56 -174.76 34.3 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 125.479 1.514 . . . . 0.0 109.331 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 p -84.14 159.57 21.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.587 0.694 . . . . 0.0 112.106 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' A' ' 63' ' ' ARG . 6.7 p90 -139.75 165.18 27.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 168.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.34 153.23 39.43 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.934 1.294 . . . . 0.0 110.78 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.6 mt -126.09 96.69 4.82 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 125.517 1.527 . . . . 0.0 109.62 -168.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -159.81 171.61 19.17 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -171.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 56.52 23.3 7.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.29 1.436 . . . . 0.0 113.948 171.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.46 25.18 68.39 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.048 -1.032 . . . . 0.0 111.54 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -144.87 161.63 38.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.428 1.114 . . . . 0.0 111.422 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.4 tp -78.86 157.19 28.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.8 p -148.96 159.07 44.54 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 120.553 -1.342 . . . . 0.0 108.509 164.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 95.8 m-85 -133.03 165.27 25.14 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.578 1.151 . . . . 0.0 109.211 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -102.72 -156.2 25.37 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 173.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.9 t -56.76 95.04 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.355 1.062 . . . . 0.0 110.234 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mt -84.1 156.56 22.1 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.312 2.245 . . . . 0.0 109.66 167.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -171.14 166.81 39.96 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 165.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -162.62 -174.78 32.94 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 108.305 -1.918 . . . . 0.0 108.305 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.08 173.89 7.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.644 0.735 . . . . 0.0 110.61 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -125.39 73.1 1.29 Allowed 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.276 1.431 . . . . 0.0 107.221 172.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 64.4 mtm -72.71 162.02 30.01 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.862 1.665 . . . . 0.0 109.01 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -106.55 133.43 51.25 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.286 1.034 . . . . 0.0 109.482 174.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 51.0 m -126.97 -9.35 6.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.107 0.963 . . . . 0.0 113.286 166.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.3 ptp 44.69 48.41 8.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.66 1.584 . . . . 0.0 113.123 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.3 p -135.68 156.45 77.49 Favored Pre-proline 0 C--O 1.239 0.537 0 C-N-CA 124.785 1.234 . . . . 0.0 110.372 177.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.95 -25.09 20.12 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.972 2.448 . . . . 0.0 111.85 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.95 -19.36 70.33 Favored Glycine 0 C--N 1.34 0.777 0 CA-C-O 118.439 -1.201 . . . . 0.0 111.561 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.46 -63.5 2.61 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-N 119.492 1.646 . . . . 0.0 110.326 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.42 -3.42 30.42 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -165.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.9 -18.14 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 O-C-N 121.725 -0.609 . . . . 0.0 111.673 167.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -46.53 -48.86 19.25 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.714 1.606 . . . . 0.0 111.302 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -54.34 -42.3 73.85 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.217 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.08 -37.12 61.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.989 0.895 . . . . 0.0 109.194 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.77 -44.83 96.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.192 0.597 . . . . 0.0 110.792 -174.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.72 -40.85 96.53 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.034 0.379 . . . . 0.0 109.983 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -17.66 64.66 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.58 0.752 . . . . 0.0 112.573 177.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.38 2.8 37.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.32 2.248 . . . . 0.0 112.281 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.0 mt -93.5 -26.89 16.97 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.116 1.325 . . . . 0.0 112.514 176.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.16 -11.04 42.3 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.794 1.179 . . . . 0.0 112.552 -178.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -96.98 106.51 18.86 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 168.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -136.02 65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 104.834 -2.284 . . . . 0.0 104.834 172.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.2 -33.76 73.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 116.276 -1.821 . . . . 0.0 109.93 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.594 ' HB2' ' CG1' ' A' ' 131' ' ' VAL . 74.5 mtt-85 -129.03 172.63 11.19 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-N 121.803 2.092 . . . . 0.0 112.981 162.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 m -150.44 150.93 31.99 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.822 1.649 . . . . 0.0 106.734 175.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -136.3 106.47 0.56 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 172.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -86.54 108.67 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 172.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 73.05 3.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 168.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttm -73.71 74.67 1.55 Allowed 'General case' 0 C--N 1.341 0.225 0 CA-C-O 122.717 1.246 . . . . 0.0 107.92 171.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -148.26 112.8 5.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 102.308 -3.219 . . . . 0.0 102.308 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.59 134.99 95.4 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-O 116.907 -1.521 . . . . 0.0 108.0 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -76.09 123.36 9.26 Favored 'Cis proline' 0 N--CA 1.451 -1.018 0 CA-C-N 120.847 1.338 . . . . 0.0 109.978 -2.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -61.72 149.57 39.32 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.297 1.046 . . . . 0.0 111.232 -173.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.54 163.69 31.34 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 126.487 1.915 . . . . 0.0 106.159 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.92 167.49 16.55 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 122.733 1.254 . . . . 0.0 109.098 173.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -148.45 135.4 20.06 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -130.59 153.77 48.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.594 ' CG1' ' HB2' ' A' ' 117' ' ' ARG . 2.6 p -138.45 158.43 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 119.854 -0.739 . . . . 0.0 111.812 175.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -103.64 158.22 16.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 122.5 1.143 . . . . 0.0 108.944 175.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -21.12 66.48 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 126.273 1.829 . . . . 0.0 110.841 -166.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -71.81 -35.62 70.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 128.351 2.66 . . . . 0.0 111.065 171.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 126.83 -2.97 7.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 126.485 1.993 . . . . 0.0 113.463 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -68.01 110.46 3.93 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.193 -1.181 . . . . 0.0 108.363 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 28.4 m -108.64 106.78 16.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.705 1.602 . . . . 0.0 109.483 -168.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.59 160.41 22.52 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.616 -1.303 . . . . 0.0 109.645 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 61.6 m -137.78 128.86 27.45 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.289 -1.507 . . . . 0.0 109.374 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -118.28 146.28 44.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.604 -175.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -88.19 151.85 22.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 166.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -66.77 135.41 53.93 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 159.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -136.49 113.97 10.92 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.756 -2.683 . . . . 0.0 103.756 158.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.9 p -126.21 12.95 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.321 1.448 . . . . 0.0 111.356 173.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 C-N-CA 123.851 0.86 . . . . 0.0 111.622 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -127.86 147.85 64.7 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 123.87 0.868 . . . . 0.0 112.423 -167.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.49 -26.41 34.33 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 124.132 3.221 . . . . 0.0 112.09 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.06 -18.7 3.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.95 1.7 . . . . 0.0 112.587 173.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -120.09 18.81 12.36 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.615 1.966 . . . . 0.0 111.016 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.7 m -112.24 -14.2 13.38 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.307 0.958 . . . . 0.0 112.62 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -10.09 59.15 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 120.569 -1.332 . . . . 0.0 113.076 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.41 16.32 20.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.06 0.944 . . . . 0.0 109.214 -175.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.66 14.37 3.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.145 1.778 . . . . 0.0 113.75 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -76.0 -39.05 56.62 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 120.917 1.69 . . . . 0.0 112.033 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.63 -0.91 9.08 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -162.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.2 p -95.32 166.88 11.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.309 1.044 . . . . 0.0 111.642 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.7 m -144.96 149.2 34.8 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.787 1.635 . . . . 0.0 109.515 -169.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -157.93 172.88 17.66 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.781 1.232 . . . . 0.0 112.137 -150.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.02 119.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.0 tp -60.71 127.86 33.75 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.53 -11.87 3.5 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 123.847 0.717 . . . . 0.0 111.527 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.52 151.28 32.43 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 119.607 1.094 . . . . 0.0 110.579 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -138.73 112.49 8.38 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.42 139.95 31.78 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 173.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -70.04 171.17 9.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 160.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.5 84.17 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.203 -0.311 . . . . 0.0 110.664 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 0.9 44.96 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.072 0.949 . . . . 0.0 111.601 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.67 -2.69 49.2 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-O 118.816 -0.991 . . . . 0.0 113.208 168.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 m -61.16 103.81 0.32 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.061 1.344 . . . . 0.0 108.818 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 119.01 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 120.779 -1.201 . . . . 0.0 109.684 169.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -73.24 155.43 39.55 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.092 0.957 . . . . 0.0 109.469 170.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.99 141.35 43.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.421 163.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -138.96 158.59 69.49 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 125.638 1.575 . . . . 0.0 108.24 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.4 109.0 1.92 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.07 1.846 . . . . 0.0 109.706 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.13 173.9 1.77 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.022 0.929 . . . . 0.0 110.5 174.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.11 12.08 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.263 -0.898 . . . . 0.0 110.37 170.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -71.61 -6.56 41.77 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -67.96 -13.45 62.18 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.867 1.212 . . . . 0.0 112.274 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 127.3 -72.66 0.46 Allowed Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.732 1.151 . . . . 0.0 112.131 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.69 85.21 21.24 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 126.101 1.761 . . . . 0.0 109.691 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.01 163.77 37.4 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.346 2.697 . . . . 0.0 112.754 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 16.3 mt -87.16 87.84 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.332 1.053 . . . . 0.0 108.741 177.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.27 130.14 54.18 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -174.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.2 tp -114.39 139.29 49.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.848 1.659 . . . . 0.0 106.942 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 m -125.81 137.73 53.79 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 168.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.5 128.47 56.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 167.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -169.74 177.29 4.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 40.8 p -93.27 47.74 1.28 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 109.647 164.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -61.63 -51.96 66.34 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.069 -1.02 . . . . 0.0 110.03 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -71.38 -25.23 62.27 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.794 -0.566 . . . . 0.0 111.069 177.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.33 0.01 29.6 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.471 1.51 . . . . 0.0 113.848 -167.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -118.14 154.92 31.33 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.907 1.683 . . . . 0.0 108.415 166.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -76.99 78.0 3.54 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.677 1.191 . . . . 0.0 109.809 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -130.45 163.85 26.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.487 1.136 . . . . 0.0 113.939 -173.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.02 100.42 10.01 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 125.89 1.676 . . . . 0.0 106.823 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -108.33 63.69 0.61 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.592 1.187 . . . . 0.0 111.446 -177.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -110.21 169.14 13.37 Favored Glycine 0 N--CA 1.467 0.763 0 C-N-CA 125.146 1.355 . . . . 0.0 111.324 -163.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.6 t80 -95.03 129.9 41.92 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.6 t -108.16 175.09 5.6 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 163.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.84 -29.77 2.14 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 127.36 2.41 . . . . 0.0 116.639 -156.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.5 t -135.65 -27.03 1.19 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 118.757 1.278 . . . . 0.0 112.716 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.09 137.58 51.33 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.429 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.1 ptt180 -65.67 -174.74 0.23 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.82 -1.536 . . . . 0.0 110.43 170.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -149.91 168.48 23.66 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 124.103 0.961 . . . . 0.0 109.218 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -153.83 153.85 32.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 126.981 2.112 . . . . 0.0 105.965 167.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -164.59 -113.21 0.28 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.498 -1.841 . . . . 0.0 108.498 164.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.82 168.25 20.67 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 126.745 2.018 . . . . 0.0 106.951 157.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -118.43 -179.23 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.719 1.208 . . . . 0.0 108.848 165.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -164.41 116.88 1.32 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.332 0.969 . . . . 0.0 111.256 172.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.04 113.37 12.28 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.133 0.973 . . . . 0.0 109.203 -174.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -148.65 168.53 22.59 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.799 1.24 . . . . 0.0 108.116 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 t0 48.43 23.08 0.54 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.005 2.122 . . . . 0.0 116.064 172.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.53 20.49 71.87 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-O 117.136 -1.925 . . . . 0.0 111.976 -172.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.11 170.73 12.61 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 128.074 2.55 . . . . 0.0 111.572 -176.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.6 99.58 7.84 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -97.92 157.56 16.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -122.2 175.76 6.21 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.075 1.35 . . . . 0.0 110.379 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.25 -162.75 18.84 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 126.078 1.799 . . . . 0.0 109.483 172.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.2 t -59.01 115.13 2.94 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 163.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.03 155.78 18.39 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.889 1.275 . . . . 0.0 109.127 176.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.87 157.86 12.87 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 163.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.51 91.89 0.1 OUTLIER Glycine 0 CA--C 1.523 0.58 0 CA-C-N 119.187 1.493 . . . . 0.0 114.884 172.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 82.4 p 63.72 175.33 0.17 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 131.508 3.923 . . . . 0.0 112.004 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -137.86 53.4 1.84 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.921 1.689 . . . . 0.0 109.107 -176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.2 mtm -61.62 170.74 1.79 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.184 0.994 . . . . 0.0 110.425 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.03 128.92 54.82 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.687 1.195 . . . . 0.0 110.414 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 74.3 m -134.28 101.47 5.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 126.446 1.898 . . . . 0.0 106.553 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 22.9 ptp -70.64 44.78 0.08 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.025 1.73 . . . . 0.0 113.22 -177.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.4 p -129.02 161.7 56.51 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 125.855 1.662 . . . . 0.0 107.801 -169.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.06 -47.53 6.36 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.165 1.91 . . . . 0.0 110.085 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.43 -1.76 66.13 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.775 -1.014 . . . . 0.0 112.361 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.95 -42.07 6.1 Favored Glycine 0 C--N 1.336 0.559 0 CA-C-N 118.849 1.324 . . . . 0.0 110.547 175.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.34 -16.34 40.3 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.213 1.006 . . . . 0.0 112.818 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.91 -15.34 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.771 0.829 . . . . 0.0 112.44 173.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -44.75 -47.51 10.78 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 125.604 1.561 . . . . 0.0 110.093 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -53.36 -47.61 61.87 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 119.579 -0.567 . . . . 0.0 111.785 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.97 74.43 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.682 0.741 . . . . 0.0 110.876 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.86 -42.71 90.06 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.7 -0.625 . . . . 0.0 110.216 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.24 -14.3 62.78 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.751 -1.218 . . . . 0.0 112.016 173.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.45 -8.32 45.01 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 169.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.92 -37.31 13.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.4 mt -72.93 -4.83 34.57 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.708 -1.245 . . . . 0.0 112.067 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 76.9 p -78.08 -8.47 58.26 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.674 1.189 . . . . 0.0 111.54 168.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -122.2 71.46 1.01 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.549 1.94 . . . . 0.0 107.633 -174.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.8 mm -107.95 66.2 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -73.8 -42.27 61.21 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 116.624 -2.03 . . . . 0.0 110.334 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -121.72 172.82 7.86 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.009 1.724 . . . . 0.0 110.578 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.414 ' HG1' ' CD2' ' A' ' 130' ' ' LEU . 11.4 t -168.52 172.34 8.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -168.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 174.57 103.13 0.16 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 171.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 67.8 t -88.13 150.92 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 120.506 -1.585 . . . . 0.0 109.641 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.26 93.13 4.34 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.7 ttm -91.58 54.28 2.46 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 123.219 1.485 . . . . 0.0 110.052 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -135.55 126.11 26.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.245 -2.502 . . . . 0.0 104.245 170.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.82 128.6 93.81 Favored Pre-proline 0 N--CA 1.446 -0.659 0 CA-C-O 117.103 -1.427 . . . . 0.0 107.151 171.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.39 114.67 3.2 Favored 'Cis proline' 0 CA--C 1.539 0.749 0 O-C-N 123.531 1.279 . . . . 0.0 114.099 5.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.95 137.55 41.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.811 0.845 . . . . 0.0 110.778 -170.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -146.77 161.89 39.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.202 1.801 . . . . 0.0 108.0 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.33 148.66 27.78 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 171.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -129.42 133.58 47.41 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.311 0.577 . . . . 0.0 109.723 159.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.414 ' CD2' ' HG1' ' A' ' 118' ' ' THR . 90.2 mt -117.65 148.5 41.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.775 1.23 . . . . 0.0 109.638 169.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.8 t -130.95 123.25 53.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -171.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 12.0 mt -71.64 166.93 20.87 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.64 -21.79 41.77 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.135 1.374 . . . . 0.0 111.259 173.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -80.97 -23.65 38.63 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 126.366 1.866 . . . . 0.0 111.72 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.74 -1.57 56.84 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 124.303 0.954 . . . . 0.0 113.448 -170.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.14 146.35 15.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.406 1.482 . . . . 0.0 108.623 170.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.4 m -135.56 102.84 5.24 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.63 1.172 . . . . 0.0 109.15 -163.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.1 mp -93.5 128.05 39.44 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.402 -1.436 . . . . 0.0 109.167 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 32.2 m -107.68 131.92 53.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.533 1.133 . . . . 0.0 108.154 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -127.28 153.79 45.7 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.996 0.919 . . . . 0.0 110.625 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.36 156.31 20.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 117.489 -1.243 . . . . 0.0 108.553 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -85.88 95.35 9.43 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.987 1.721 . . . . 0.0 107.453 162.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -92.0 76.33 5.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 6.4 t -82.24 13.2 3.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 115.736 -2.078 . . . . 0.0 110.897 -172.408 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 CA--C 1.538 0.482 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -84.92 144.36 41.67 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 118.231 0.469 . . . . 0.0 112.065 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.97 -23.28 30.03 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.761 2.308 . . . . 0.0 112.03 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.73 -1.73 1.46 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.405 1.882 . . . . 0.0 114.345 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.02 3.99 14.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.48 1.512 . . . . 0.0 112.004 -178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.475 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.3 t -74.86 -12.24 60.33 Favored 'General case' 0 CA--C 1.556 1.183 0 O-C-N 121.447 -0.783 . . . . 0.0 111.119 -175.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -8.37 34.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 118.992 -2.318 . . . . 0.0 112.641 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.2 mt -105.9 21.08 17.9 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.337 1.055 . . . . 0.0 112.391 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.475 ' CD2' ' HA ' ' A' ' 20' ' ' THR . 3.1 mm? -110.08 62.5 0.6 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.264 1.826 . . . . 0.0 109.169 -175.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 p-10 -137.29 -41.03 0.57 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 123.689 0.796 . . . . 0.0 112.129 -163.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -136.41 16.76 3.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.354 1.073 . . . . 0.0 110.897 -177.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.7 170.24 8.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.191 2.997 . . . . 0.0 109.114 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.3 m -152.18 148.27 27.41 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 119.295 -2.128 . . . . 0.0 110.096 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 28.0 m95 -148.78 175.3 11.35 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.067 1.347 . . . . 0.0 110.221 -162.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.9 t -146.29 127.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.82 133.1 47.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 t -133.56 -9.92 2.81 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.41 140.78 18.69 Favored 'General case' 0 C--N 1.339 0.143 0 O-C-N 120.629 -1.295 . . . . 0.0 109.351 -175.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -135.28 98.76 4.05 Favored 'General case' 0 C--N 1.334 -0.106 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.82 136.61 34.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 120.447 -1.408 . . . . 0.0 107.312 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -66.97 163.83 18.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 157.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.57 84.47 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.247 0.546 . . . . 0.0 111.033 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -12.63 59.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 122.776 0.43 . . . . 0.0 110.427 -175.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 119.46 -4.59 13.38 Favored Glycine 0 C--N 1.34 0.798 0 CA-C-O 118.317 -1.268 . . . . 0.0 114.276 169.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -73.22 107.75 5.72 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.894 1.847 . . . . 0.0 108.84 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.51 110.3 1.64 Allowed 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.631 0.772 . . . . 0.0 109.89 166.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -62.0 154.42 26.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.498 1.519 . . . . 0.0 110.308 172.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.66 132.61 47.82 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 m -138.87 156.35 72.73 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 124.402 1.081 . . . . 0.0 109.876 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.15 108.69 2.21 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.45 2.1 . . . . 0.0 110.249 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 168.78 12.96 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.091 0.956 . . . . 0.0 111.033 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.26 -7.95 46.33 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.369 1.468 . . . . 0.0 112.836 170.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -118.51 9.92 12.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.304 2.242 . . . . 0.0 111.078 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -98.63 -10.35 23.44 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.298 -0.876 . . . . 0.0 112.346 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.59 -45.0 1.19 Allowed Glycine 0 C--N 1.335 0.509 0 C-N-CA 123.847 0.736 . . . . 0.0 114.312 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.87 79.53 27.33 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 127.032 2.133 . . . . 0.0 109.8 -170.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -66.22 158.41 54.97 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 123.135 2.557 . . . . 0.0 111.231 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.1 mt -90.22 113.54 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 C-N-CA 124.341 1.056 . . . . 0.0 108.229 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.9 p -119.06 140.72 49.58 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 -171.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.1 tp -125.5 140.48 52.73 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.13 1.372 . . . . 0.0 108.791 -177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 20.7 m -134.8 129.35 34.41 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.707 1.603 . . . . 0.0 107.208 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -118.75 122.95 43.66 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -168.63 -153.12 0.12 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.8 p -122.46 46.86 2.04 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.266 1.026 . . . . 0.0 112.545 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.22 -46.85 88.33 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.571 -1.331 . . . . 0.0 111.851 -173.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -77.89 1.39 20.67 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.07 -1.644 . . . . 0.0 112.342 173.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.78 -9.86 74.66 Favored Glycine 0 CA--C 1.526 0.736 0 O-C-N 120.079 -1.638 . . . . 0.0 113.119 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -104.6 160.38 14.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 119.47 1.635 . . . . 0.0 108.962 164.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -64.33 91.27 0.07 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.839 0.856 . . . . 0.0 109.604 171.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -133.74 155.28 50.04 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.603 0.716 . . . . 0.0 110.021 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.79 146.78 26.62 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.62 151.95 45.81 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 154.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.45 177.92 48.06 Favored Glycine 0 N--CA 1.445 -0.763 0 O-C-N 121.222 -0.923 . . . . 0.0 112.227 -174.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -125.13 105.57 9.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.69 1.196 . . . . 0.0 107.994 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -85.03 -1.35 56.72 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 125.083 1.353 . . . . 0.0 113.915 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 149.48 -74.71 0.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 109.374 -1.49 . . . . 0.0 109.374 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 18.0 t -151.05 14.78 0.72 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 1.157 . . . . 0.0 113.386 177.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.08 -6.01 10.47 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.081 -1.637 . . . . 0.0 112.327 172.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 52.65 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.515 1.526 . . . . 0.0 111.441 -162.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -151.72 153.28 34.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.558 167.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -145.41 161.25 40.13 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.692 1.997 . . . . 0.0 107.19 170.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.46 163.43 11.6 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 171.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.3 m -69.59 163.91 24.45 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.935 0.894 . . . . 0.0 111.329 -170.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -137.93 171.94 13.68 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.53 0.732 . . . . 0.0 111.598 172.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.06 150.38 31.65 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.881 1.672 . . . . 0.0 108.024 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 70.1 mt -117.63 117.36 29.17 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -164.44 168.4 18.5 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.753 1.221 . . . . 0.0 109.285 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.0 t0 48.19 23.4 0.53 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.04 77.88 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 120.085 -1.634 . . . . 0.0 113.148 -175.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -141.37 140.9 33.8 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.065 1.933 . . . . 0.0 112.164 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.88 105.15 13.65 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.852 1.661 . . . . 0.0 108.697 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.9 m -106.88 159.05 16.55 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.789 0.804 . . . . 0.0 109.534 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -115.59 -165.92 1.08 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.69 1.196 . . . . 0.0 110.435 -167.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.37 -87.77 1.7 Allowed Glycine 0 C--N 1.334 0.433 0 O-C-N 120.717 -1.24 . . . . 0.0 110.085 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.8 m -154.69 69.22 0.74 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.526 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -61.92 164.2 6.76 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 120.923 -1.111 . . . . 0.0 112.494 -173.219 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -177.3 -179.98 47.83 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 169.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.13 -158.25 7.57 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.505 1.05 . . . . 0.0 111.642 -171.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 58.7 p -88.32 178.98 6.43 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 166.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -128.28 59.16 1.52 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.306 1.412 . . . . 0.0 110.724 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.9 mtm -59.19 165.06 2.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.493 161.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.93 153.33 24.66 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -134.71 159.64 40.65 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 123.629 0.771 . . . . 0.0 109.741 169.456 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -111.61 19.54 18.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 124.818 1.247 . . . . 0.0 110.772 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.4 p -96.49 165.09 16.8 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.125 1.77 . . . . 0.0 108.133 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.77 -42.06 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.261 1.974 . . . . 0.0 109.572 165.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.47 7.31 48.25 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-O 118.319 -1.267 . . . . 0.0 112.927 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.82 -55.84 2.08 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 108.136 -1.986 . . . . 0.0 108.136 170.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -60.47 -27.03 67.23 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.871 0.868 . . . . 0.0 112.487 -174.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -63.63 -17.91 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.581 0.752 . . . . 0.0 112.3 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.04 -40.91 64.27 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 119.364 0.984 . . . . 0.0 110.404 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.57 -28.18 72.07 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.088 -0.84 . . . . 0.0 111.973 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -80.42 -45.41 17.69 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.355 1.077 . . . . 0.0 110.031 171.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.14 -46.6 86.47 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 111.115 -171.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.54 -47.46 69.97 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 118.422 0.556 . . . . 0.0 109.549 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.57 -32.49 74.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.044 0.538 . . . . 0.0 111.735 -177.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.21 -26.49 68.15 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.303 0.641 . . . . 0.0 111.357 174.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 77.4 mt -69.02 -12.11 61.39 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.997 0.817 . . . . 0.0 112.25 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.3 p -91.3 -4.57 55.74 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.327 0.967 . . . . 0.0 111.806 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -117.82 71.52 0.82 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.9 mm -107.62 83.13 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 106.201 -1.778 . . . . 0.0 106.201 172.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -95.91 -28.87 14.48 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 119.365 -0.934 . . . . 0.0 112.257 166.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -130.16 166.54 20.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 122.493 1.14 . . . . 0.0 110.303 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.9 m -162.81 170.02 18.94 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 -177.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.44 143.04 10.18 Favored Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 105.319 -3.113 . . . . 0.0 105.319 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.6 t -129.47 128.52 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 174.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.01 88.82 2.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 -174.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 50.39 0.61 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.854 1.788 . . . . 0.0 111.659 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.24 128.39 48.22 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.219 2.607 . . . . 0.0 104.358 170.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.22 136.3 80.97 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-O 117.204 -1.379 . . . . 0.0 107.684 147.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -72.67 121.89 7.01 Favored 'Cis proline' 0 N--CA 1.456 -0.703 0 CA-C-N 120.341 1.157 . . . . 0.0 110.825 -8.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.68 138.9 41.63 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.622 0.725 . . . . 0.0 110.884 -171.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -146.27 153.76 40.94 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 171.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 44.8 ttp -116.36 145.31 43.31 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.491 1.516 . . . . 0.0 107.675 176.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . 0.404 HE21 ' CG2' ' A' ' 137' ' ' THR . 27.2 mt-30 -133.65 102.81 5.62 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.384 0.993 . . . . 0.0 110.868 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 73.3 mt -80.62 148.88 30.08 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 66.0 t -131.72 128.47 60.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 11.2 mt -81.49 156.49 25.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.75 -36.19 35.35 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.731 1.612 . . . . 0.0 112.454 177.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.75 -6.26 58.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.075 1.35 . . . . 0.0 111.27 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.96 -4.22 14.18 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.93 1.729 . . . . 0.0 114.897 157.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.28 156.83 7.02 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 109.845 -178.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' THR . . . . . 0.404 ' CG2' HE21 ' A' ' 129' ' ' GLN . 27.2 m -140.0 97.76 3.31 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.299 -0.876 . . . . 0.0 109.548 -172.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.36 142.58 30.93 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 35.7 m -127.85 129.6 47.2 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 125.82 1.648 . . . . 0.0 107.676 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.42 121.66 27.8 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.619 1.168 . . . . 0.0 108.714 -167.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.93 144.24 41.18 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -70.57 129.43 39.18 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 172.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 47.8 t -136.13 83.94 2.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.52 19.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.202 1.401 . . . . 0.0 112.425 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 CA-C-O 114.56 -2.638 . . . . 0.0 110.441 -167.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.9 t30 42.03 75.41 0.62 Allowed Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 127.748 2.419 . . . . 0.0 114.25 164.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -60.3 -17.72 48.44 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.178 2.585 . . . . 0.0 114.856 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.18 0.4 9.83 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.742 -1.224 . . . . 0.0 113.631 169.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.58 -26.19 54.8 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.998 1.719 . . . . 0.0 112.184 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -62.14 -30.03 70.76 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.324 1.42 . . . . 0.0 111.669 -160.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -20.14 63.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.039 0.936 . . . . 0.0 113.088 177.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.47 -7.58 59.6 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.248 1.019 . . . . 0.0 110.797 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -77.7 5.02 10.14 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.684 -0.635 . . . . 0.0 110.49 173.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -73.1 -20.68 60.9 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 127.433 2.293 . . . . 0.0 112.54 171.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.28 51.38 0.36 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -163.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -153.09 139.13 18.21 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.128 -1.608 . . . . 0.0 109.673 177.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 m -84.5 -64.48 1.15 Allowed 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 -166.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 15.8 m95 75.5 160.94 0.23 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.948 3.299 . . . . 0.0 115.369 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 p -150.19 115.54 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.033 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.81 134.93 53.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.044 0.84 . . . . 0.0 109.456 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 t -144.06 -2.23 0.92 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -155.12 150.86 27.6 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.462 -1.399 . . . . 0.0 111.455 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -139.2 132.12 29.36 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.758 2.023 . . . . 0.0 105.988 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.28 135.21 53.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.969 2.107 . . . . 0.0 107.36 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -78.13 170.2 17.01 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.221 0.534 . . . . 0.0 109.583 169.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.06 -15.71 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.07 3.82 44.58 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.756 1.223 . . . . 0.0 110.915 173.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.82 -7.72 81.22 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 124.559 1.076 . . . . 0.0 112.784 175.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 44.5 m -60.94 105.15 0.43 Allowed 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 126.969 2.108 . . . . 0.0 109.883 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.11 111.82 6.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.619 0.767 . . . . 0.0 109.658 170.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.07 155.02 39.77 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.656 0.783 . . . . 0.0 110.751 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.25 141.36 48.94 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 160.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.9 m -143.05 165.9 23.43 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 128.394 2.677 . . . . 0.0 105.63 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -64.42 124.66 13.68 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 CA-C-N 121.478 1.564 . . . . 0.0 108.516 168.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.77 153.86 42.38 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 123.843 0.857 . . . . 0.0 109.96 170.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.78 98.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.961 -0.462 . . . . 0.0 110.751 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.48 2.26 12.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.215 1.006 . . . . 0.0 112.052 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -84.67 -19.09 33.39 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.507 -0.759 . . . . 0.0 111.166 168.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 150.73 -84.14 0.16 Allowed Glycine 0 C--N 1.339 0.709 0 CA-C-N 119.589 1.086 . . . . 0.0 111.703 173.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -120.25 85.23 35.95 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 124.289 1.035 . . . . 0.0 109.945 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.12 175.46 3.19 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.684 2.922 . . . . 0.0 113.178 -178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.43 HG12 ' H ' ' A' ' 70' ' ' GLY . 20.5 mt -85.08 76.82 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 124.928 1.291 . . . . 0.0 109.32 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.11 127.68 35.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 104.174 -2.528 . . . . 0.0 104.174 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.2 tp -86.59 156.91 19.85 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 172.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -142.3 122.69 13.99 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 168.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 mt -117.89 114.3 23.02 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -164.58 -169.06 1.65 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.038 1.735 . . . . 0.0 108.271 177.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.9 p -130.77 27.7 4.92 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.883 -1.136 . . . . 0.0 114.023 -164.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 t -55.67 -49.02 74.03 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.157 -0.965 . . . . 0.0 112.28 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.3 t -70.5 5.71 1.7 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.773 1.17 . . . . 0.0 112.612 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.52 -5.6 73.0 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 119.765 -1.835 . . . . 0.0 113.692 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -115.49 152.51 32.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 118.976 1.388 . . . . 0.0 111.583 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 ptp85 -70.88 74.35 0.61 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.906 1.682 . . . . 0.0 110.385 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -130.51 147.61 52.22 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.199 -0.938 . . . . 0.0 110.093 -178.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.36 155.39 24.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -158.78 98.73 1.51 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 109.127 159.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -101.25 -158.76 27.16 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 15.4 t80 -126.02 122.41 35.8 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 104.558 -2.386 . . . . 0.0 104.558 174.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.466 ' CB ' ' CZ ' ' A' ' 108' ' ' TYR . 18.7 t -117.15 100.22 7.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.886 2.13 . . . . 0.0 111.315 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . 0.43 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 76.59 -71.99 2.03 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 125.498 1.523 . . . . 0.0 111.855 172.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.8 t -135.62 -2.1 2.46 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.094 1.358 . . . . 0.0 111.353 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.486 ' ND2' ' H ' ' A' ' 95' ' ' MET . 5.3 m120 -136.49 108.74 7.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -162.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -62.16 159.57 14.48 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 122.466 1.127 . . . . 0.0 110.954 162.438 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -139.64 174.25 10.7 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 112.117 -2.311 . . . . 0.0 108.324 -168.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -159.96 165.6 31.71 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.927 0.891 . . . . 0.0 109.862 173.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 151.96 165.22 12.9 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 124.772 1.177 . . . . 0.0 110.794 164.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 60.6 p -74.12 168.02 20.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.737 0.769 . . . . 0.0 110.778 -163.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -135.51 176.47 8.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.822 0.849 . . . . 0.0 112.304 170.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.48 149.54 30.12 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.326 1.85 . . . . 0.0 107.726 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 74.5 mt -128.42 78.67 1.86 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.775 1.23 . . . . 0.0 108.419 -163.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -147.1 168.16 22.29 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.445 1.098 . . . . 0.0 109.512 -169.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.5 t70 56.81 25.07 9.89 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.043 0.937 . . . . 0.0 112.513 169.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.32 -11.39 37.83 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.084 1.802 . . . . 0.0 113.662 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -121.21 137.25 54.76 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.841 2.321 . . . . 0.0 113.311 -163.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 38.4 tp -67.81 107.21 2.53 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 167.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.5 m -100.84 164.73 11.7 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.319 1.048 . . . . 0.0 109.211 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -137.21 147.72 46.02 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.703 0.801 . . . . 0.0 110.909 -175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.01 -154.31 27.27 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.269 1.89 . . . . 0.0 110.611 171.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.5 m -64.18 98.41 0.22 Allowed 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.3 0.64 . . . . 0.0 109.733 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -84.96 166.24 16.93 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 170.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 167.83 -171.81 42.4 Favored Glycine 0 CA--C 1.53 0.987 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.46 -150.9 8.22 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 118.93 1.365 . . . . 0.0 112.854 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.2 p -85.11 171.15 12.25 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.437 1.495 . . . . 0.0 112.051 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.6 mtt180 -130.04 62.03 1.57 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.572 1.149 . . . . 0.0 110.87 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.486 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 2.7 mtt -82.04 149.39 28.11 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.171 -0.955 . . . . 0.0 108.443 175.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -90.44 140.74 29.44 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.619 0.768 . . . . 0.0 110.855 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -117.55 -21.95 8.34 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 172.218 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 68.25 19.23 9.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.753 1.221 . . . . 0.0 112.213 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 81.2 p -120.59 155.5 56.73 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 126.44 1.896 . . . . 0.0 110.784 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.2 -28.57 47.99 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.543 2.162 . . . . 0.0 111.815 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.8 -8.41 87.77 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-O 117.994 -1.448 . . . . 0.0 113.126 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.63 -47.74 9.75 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-N 119.74 1.77 . . . . 0.0 109.315 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -70.21 -24.05 63.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.072 0.936 . . . . 0.0 113.367 -167.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.9 tt -64.49 -9.1 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 O-C-N 121.679 -0.638 . . . . 0.0 112.276 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.407 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 8.3 tm-20 -61.47 -16.09 43.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.366 2.266 . . . . 0.0 111.848 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -83.71 -29.05 33.34 Favored Glycine 0 CA--C 1.525 0.672 0 O-C-N 120.079 -1.638 . . . . 0.0 112.947 170.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.65 -47.09 20.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.713 1.256 . . . . 0.0 109.621 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.466 ' CZ ' ' CB ' ' A' ' 69' ' ' SER . 0.3 OUTLIER -61.09 -37.45 82.79 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 122.965 0.506 . . . . 0.0 111.524 -162.149 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.435 HD12 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -69.96 -47.28 62.93 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.571 1.948 . . . . 0.0 109.386 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -14.15 56.22 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.402 1.081 . . . . 0.0 113.062 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -94.97 -28.97 14.88 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.057 1.343 . . . . 0.0 111.502 174.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.6 mt -71.59 -8.93 57.11 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.683 -1.261 . . . . 0.0 113.194 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 9.9 p -80.56 -9.94 59.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.17 0.895 . . . . 0.0 112.338 171.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -122.35 71.05 1.0 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 125.208 1.403 . . . . 0.0 109.759 -168.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.4 mm -103.61 54.16 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -28.42 69.89 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.803 -0.56 . . . . 0.0 111.048 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -141.14 166.23 25.34 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.665 1.586 . . . . 0.0 110.266 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.2 t -160.05 161.93 34.06 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.22 83.61 0.14 Allowed Glycine 0 CA--C 1.524 0.651 0 CA-C-O 119.799 -0.445 . . . . 0.0 113.286 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.5 p -91.14 97.19 6.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.684 1.742 . . . . 0.0 111.83 170.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.72 98.63 9.78 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.493 1.117 . . . . 0.0 108.512 171.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.0 mtt -86.32 30.57 0.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.411 1.484 . . . . 0.0 114.415 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.02 89.85 3.21 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 120.292 -1.505 . . . . 0.0 110.7 -166.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -36.53 120.56 0.76 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 126.441 1.897 . . . . 0.0 112.652 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.06 126.68 9.24 Favored 'Cis proline' 0 N--CA 1.459 -0.554 0 CA-C-N 119.908 1.003 . . . . 0.0 111.724 1.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -83.84 145.04 28.87 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -140.32 179.61 6.55 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 165.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -132.93 147.65 52.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 162.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -119.04 151.12 38.81 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 126.266 1.826 . . . . 0.0 108.0 170.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.5 mt -114.44 153.44 29.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 113.541 -1.663 . . . . 0.0 106.724 155.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 41.9 t -140.49 118.98 10.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 173.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 39.5 mt -76.18 173.65 11.07 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.288 1.042 . . . . 0.0 110.933 178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -57.56 -17.62 15.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.267 1.427 . . . . 0.0 113.355 158.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -78.5 -2.44 38.66 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.38 16.96 78.75 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 124.074 0.845 . . . . 0.0 112.457 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -173.24 0.44 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.831 0.852 . . . . 0.0 112.237 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 31.4 m -148.79 125.66 11.23 Favored 'General case' 0 N--CA 1.461 0.125 0 O-C-N 119.165 -2.21 . . . . 0.0 108.189 159.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.48 161.2 14.55 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.094 0.958 . . . . 0.0 108.485 170.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 42.1 m -143.08 123.33 13.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.297 0.639 . . . . 0.0 110.515 -168.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -125.88 143.6 51.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.327 1.851 . . . . 0.0 110.981 -172.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.45 164.9 22.68 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 119.612 1.096 . . . . 0.0 108.813 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -87.62 97.72 11.02 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 156.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.7 t -109.62 52.87 0.71 Allowed 'General case' 0 C--O 1.219 -0.516 0 O-C-N 120.955 -1.09 . . . . 0.0 108.552 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.4 t -76.88 8.02 4.18 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.372 -0.83 . . . . 0.0 111.987 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 124.062 0.945 . . . . 0.0 109.732 -173.824 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -131.16 144.78 54.92 Favored Pre-proline 0 N--CA 1.469 0.51 0 C-N-CA 123.841 0.856 . . . . 0.0 111.202 -166.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.15 -12.0 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.175 2.583 . . . . 0.0 112.257 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.95 -2.1 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.788 -1.195 . . . . 0.0 113.002 165.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.6 21.93 10.74 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.909 2.083 . . . . 0.0 110.818 172.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.4 m -84.8 -62.55 1.52 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.945 1.248 . . . . 0.0 113.949 169.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . 0.504 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -61.43 -26.09 67.65 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.081 1.764 . . . . 0.0 115.237 -160.27 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.465 ' C ' ' H ' ' A' ' 24' ' ' ASP . 5.5 mt -75.73 -6.11 48.96 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.838 1.655 . . . . 0.0 111.168 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.14 17.31 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.689 1.196 . . . . 0.0 111.963 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -89.03 -11.25 44.71 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.007 1.723 . . . . 0.0 112.054 171.645 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -128.11 -12.04 5.23 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.0 p -82.62 170.25 15.36 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.593 -0.692 . . . . 0.0 111.839 -172.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -144.64 148.95 34.91 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -153.14 165.63 35.05 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 125.209 1.404 . . . . 0.0 108.98 -164.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 74.3 t -143.04 120.66 6.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.75 132.77 53.34 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -139.21 -14.12 1.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.078 0.769 . . . . 0.0 113.078 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.43 43.82 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.916 1.234 . . . . 0.0 109.337 166.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -142.06 93.96 2.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 133.96 45.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 171.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -65.02 164.41 12.85 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 156.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.1 65.57 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.937 0.495 . . . . 0.0 111.992 -172.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.21 -18.43 23.47 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.327 1.051 . . . . 0.0 112.529 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 127.37 -6.05 7.16 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 115.082 0.793 . . . . 0.0 115.082 176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -69.27 103.62 2.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 119.362 1.581 . . . . 0.0 108.72 176.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 122.75 18.39 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 121.196 -0.94 . . . . 0.0 108.977 170.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.8 mtt180 -75.89 153.3 36.82 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.597 1.559 . . . . 0.0 110.312 174.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.56 125.5 26.72 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 123.775 0.83 . . . . 0.0 109.97 168.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.0 m -131.29 155.31 81.68 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 126.139 1.776 . . . . 0.0 108.028 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.49 120.88 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.568 2.178 . . . . 0.0 110.802 -178.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 168.03 8.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.346 -0.846 . . . . 0.0 111.913 164.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.28 -32.04 64.19 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 121.346 -0.846 . . . . 0.0 111.757 167.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.39 -13.3 52.61 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 121.63 -0.669 . . . . 0.0 112.517 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -75.49 -17.7 60.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.95 -22.72 5.68 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 123.735 0.683 . . . . 0.0 114.131 163.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.64 85.47 3.68 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.397 1.099 . . . . 0.0 111.087 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.84 154.26 71.38 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.93 1.753 . . . . 0.0 111.578 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.6 mt -87.48 103.22 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 127.382 2.273 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 p -123.88 135.68 53.87 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.336 -164.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -128.88 135.52 49.18 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.452 1.901 . . . . 0.0 109.432 -167.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.0 m -146.35 115.27 6.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.41 HD13 ' CE2' ' A' ' 78' ' ' TYR . 2.7 mm? -104.51 112.21 25.18 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -174.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.6 t -161.02 -174.5 4.41 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.3 p -93.75 35.42 1.14 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.969 0.908 . . . . 0.0 112.178 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.7 t -50.49 -55.27 16.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.856 1.207 . . . . 0.0 114.191 -161.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -94.0 8.8 40.06 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.572 1.078 . . . . 0.0 110.669 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.48 -24.51 5.25 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.199 1.381 . . . . 0.0 114.615 165.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' H ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -121.4 166.37 14.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 128.111 2.565 . . . . 0.0 109.288 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.417 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 3.9 ptp85 -66.94 97.01 0.46 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.71 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.5 170.86 15.0 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 123.839 1.78 . . . . 0.0 113.002 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.91 75.18 0.94 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 112.036 -2.347 . . . . 0.0 107.131 -175.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.91 86.61 4.79 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -128.68 179.49 16.58 Favored Glycine 0 CA--C 1.507 -0.415 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 -165.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -118.51 140.03 50.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.855 0.836 . . . . 0.0 109.061 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -144.99 135.1 23.93 Favored 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 128.49 2.716 . . . . 0.0 104.757 -171.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 44.14 -91.83 0.01 OUTLIER Glycine 0 CA--C 1.524 0.608 0 C-N-CA 127.514 2.483 . . . . 0.0 112.465 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.4 t -152.63 33.1 0.5 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.721 1.248 . . . . 0.0 111.572 162.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -125.03 -7.17 7.19 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 120.547 -1.346 . . . . 0.0 114.012 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 44.89 177.52 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 129.114 2.966 . . . . 0.0 113.106 -175.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -154.95 159.21 40.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.117 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.21 160.0 23.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.746 1.618 . . . . 0.0 108.61 173.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 170.82 -86.06 0.08 OUTLIER Glycine 0 CA--C 1.527 0.822 0 CA-C-O 119.479 -0.623 . . . . 0.0 112.274 163.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 p -164.56 162.21 21.56 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.585 1.954 . . . . 0.0 110.099 -178.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 37.7 p90 -143.99 171.71 13.87 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.099 0.96 . . . . 0.0 110.876 165.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -149.48 142.15 24.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 126.161 1.784 . . . . 0.0 108.617 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -102.09 93.36 5.2 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 122.179 0.99 . . . . 0.0 109.762 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -124.16 176.75 6.2 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.653 1.981 . . . . 0.0 108.695 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 52.81 14.11 0.4 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.41 2.284 . . . . 0.0 116.078 174.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 56.38 35.77 67.18 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 120.082 -1.636 . . . . 0.0 111.856 -163.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -142.66 177.31 8.39 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 127.015 2.126 . . . . 0.0 112.353 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -87.13 139.9 30.1 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.1 p -131.91 148.38 52.53 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.448 1.476 . . . . 0.0 109.948 161.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -112.88 157.66 21.15 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.286 1.034 . . . . 0.0 109.79 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.95 -153.43 25.72 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.646 1.117 . . . . 0.0 112.047 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.37 86.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.442 1.897 . . . . 0.0 108.694 170.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.52 173.44 12.58 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 120.995 -1.066 . . . . 0.0 111.605 -175.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 159.01 179.42 33.84 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 170.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.09 -109.77 0.43 Allowed Glycine 0 C--N 1.333 0.384 0 C-N-CA 125.166 1.365 . . . . 0.0 111.01 -171.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -155.61 159.49 39.67 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.796 1.638 . . . . 0.0 107.958 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -103.14 38.37 1.77 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.591 1.556 . . . . 0.0 110.371 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mtm -59.85 162.54 5.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.164 0.986 . . . . 0.0 109.549 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -107.17 144.14 34.35 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -125.49 -15.85 6.0 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 176.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.259 18.1 ptp 46.39 44.57 12.94 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.186 1.794 . . . . 0.0 112.419 -174.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 80.0 p -132.55 157.43 78.34 Favored Pre-proline 0 C--O 1.239 0.527 0 C-N-CA 125.417 1.487 . . . . 0.0 109.58 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.79 -27.69 21.25 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 121.533 1.488 . . . . 0.0 112.045 173.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -63.9 -36.1 92.85 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 169.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.08 -35.28 91.23 Favored Glycine 0 C--N 1.335 0.519 0 CA-C-N 120.096 1.948 . . . . 0.0 113.304 -170.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -86.12 -13.56 46.81 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.036 0.918 . . . . 0.0 112.85 -175.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.7 tt -68.31 -9.9 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 118.918 0.781 . . . . 0.0 111.22 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -44.74 -51.3 9.46 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.824 0.85 . . . . 0.0 110.899 166.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.7 -39.01 92.99 Favored Glycine 0 C--N 1.337 0.639 0 CA-C-O 119.089 -0.84 . . . . 0.0 111.381 -173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.41 -45.83 65.16 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.475 0.71 . . . . 0.0 110.256 175.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -63.64 -45.12 91.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.781 0.832 . . . . 0.0 110.91 -171.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.0 mt -62.72 -36.37 82.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.197 0.908 . . . . 0.0 109.827 173.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -17.78 64.76 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.079 1.352 . . . . 0.0 113.143 175.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.03 -33.06 12.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.776 1.23 . . . . 0.0 110.658 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -21.44 66.44 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.546 1.538 . . . . 0.0 112.084 176.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -81.64 -9.42 59.67 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.478 1.511 . . . . 0.0 112.842 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -133.46 65.66 1.58 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -175.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.0 mm -89.15 69.98 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 103.413 -2.81 . . . . 0.0 103.413 163.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -73.27 -44.94 58.4 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 118.785 -1.166 . . . . 0.0 109.044 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -122.07 168.19 12.25 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.222 1.809 . . . . 0.0 109.767 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.2 t -163.67 170.9 16.41 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.853 -1.154 . . . . 0.0 108.482 -167.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -177.65 104.25 0.19 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.232 -1.147 . . . . 0.0 110.232 175.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.3 p -113.13 142.87 24.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 O-C-N 121.144 -1.209 . . . . 0.0 109.598 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -120.75 78.91 1.43 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 125.888 1.675 . . . . 0.0 106.745 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 48.1 ttm -76.09 62.85 1.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.381 171.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -147.23 104.97 3.71 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -45.37 125.51 5.91 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.988 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.66 124.0 8.77 Favored 'Cis proline' 0 N--CA 1.459 -0.553 0 CA-C-N 119.95 1.018 . . . . 0.0 111.629 3.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -79.0 134.6 36.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -141.43 162.39 35.59 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 163.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -127.06 147.52 50.15 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 126.133 1.773 . . . . 0.0 106.247 172.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -146.18 128.06 15.41 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -171.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -114.3 151.36 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.47 -0.769 . . . . 0.0 109.122 -178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.42 117.6 47.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.3 mp -68.73 169.21 11.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.783 0.801 . . . . 0.0 110.865 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -53.57 -33.26 54.13 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.584 1.554 . . . . 0.0 112.058 172.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -84.19 -27.38 28.07 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.478 -0.764 . . . . 0.0 112.148 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.37 -5.17 10.17 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 117.856 -1.524 . . . . 0.0 115.179 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -52.33 127.46 22.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.56 1.68 . . . . 0.0 108.771 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.2 m -105.5 98.14 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.918 1.287 . . . . 0.0 109.17 -170.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.3 mp -83.21 142.62 31.03 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.496 -1.377 . . . . 0.0 108.608 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 54.4 m -123.73 132.04 53.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.492 1.117 . . . . 0.0 109.888 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -128.76 133.6 48.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.586 1.554 . . . . 0.0 109.384 -175.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.62 158.87 20.74 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -84.16 133.97 34.59 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -117.23 65.92 0.73 Allowed 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 7.3 t -74.81 -1.04 20.35 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 124.464 1.105 . . . . 0.0 111.569 -167.913 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 CA--C 1.535 0.373 0 CA-C-O 122.015 0.912 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t30 -166.11 148.25 6.14 Favored Pre-proline 0 C--O 1.238 0.454 0 O-C-N 121.161 -0.962 . . . . 0.0 108.581 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -63.26 -26.61 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.753 2.302 . . . . 0.0 111.276 173.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.13 4.11 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.52 -13.99 19.24 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 120.138 1.335 . . . . 0.0 111.126 165.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.46 -20.11 34.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.696 1.134 . . . . 0.0 112.883 -172.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -8.5 33.33 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 120.577 -1.327 . . . . 0.0 113.572 176.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.79 13.78 29.29 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.374 1.07 . . . . 0.0 109.867 -177.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.81 31.25 0.36 Allowed 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.007 -1.058 . . . . 0.0 110.543 177.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -85.04 -54.53 4.58 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.403 0.681 . . . . 0.0 110.044 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -118.39 2.65 11.88 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.8 1.64 . . . . 0.0 113.398 -173.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.8 p -78.97 156.33 28.53 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 123.229 1.49 . . . . 0.0 111.344 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.66 154.54 51.48 Favored 'General case' 0 N--CA 1.441 -0.925 0 O-C-N 120.332 -1.48 . . . . 0.0 109.063 -177.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -152.9 162.18 41.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -164.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.9 t -144.66 132.82 17.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -81.15 150.95 28.49 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.6 t -139.22 -23.4 0.9 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.62 161.15 43.13 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.227 -1.546 . . . . 0.0 110.224 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -140.31 139.28 35.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.772 1.629 . . . . 0.0 107.315 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.99 135.99 54.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.739 1.616 . . . . 0.0 109.683 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -69.19 160.89 30.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 109.191 163.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.01 73.64 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 111.977 172.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.89 -4.13 42.2 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.612 -0.68 . . . . 0.0 111.72 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.85 -3.05 62.37 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-O 118.26 -1.3 . . . . 0.0 112.178 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.6 m -60.67 103.95 0.3 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.053 1.427 . . . . 0.0 107.742 170.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.5 132.9 55.39 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 165.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.91 147.58 26.19 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 169.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.26 144.25 54.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 161.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -141.67 152.34 62.67 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 126.129 1.772 . . . . 0.0 106.776 170.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.08 117.29 4.62 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 121.192 1.261 . . . . 0.0 108.894 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -76.22 174.36 10.22 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.37 72.21 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.189 -0.944 . . . . 0.0 111.215 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -77.66 -7.23 56.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -79.24 -9.0 59.47 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.341 -0.849 . . . . 0.0 111.937 168.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.27 -23.7 17.8 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 118.741 -1.033 . . . . 0.0 113.179 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.02 76.7 21.73 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.632 1.173 . . . . 0.0 110.426 -168.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.87 128.21 21.43 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 122.331 2.021 . . . . 0.0 110.27 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.5 mm -60.28 96.52 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.202 1.801 . . . . 0.0 109.805 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.9 p -108.55 122.34 46.86 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.35 1.06 . . . . 0.0 108.858 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -109.28 140.5 42.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.72 1.608 . . . . 0.0 107.877 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 m -139.61 122.78 16.91 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -92.7 136.49 33.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 156.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.7 t 174.55 -154.82 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.718 2.807 . . . . 0.0 106.044 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.3 p -123.84 42.49 3.22 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.94 1.296 . . . . 0.0 111.913 -172.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.86 -6.75 2.95 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 119.546 -1.971 . . . . 0.0 114.729 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 70.8 p -122.94 -1.41 8.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.583 1.553 . . . . 0.0 112.06 166.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.55 -7.18 74.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.372 1.463 . . . . 0.0 113.24 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -89.68 170.33 10.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.005 1.903 . . . . 0.0 109.143 170.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -69.75 86.23 0.49 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 160.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.5 141.33 47.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.849 1.66 . . . . 0.0 107.388 -171.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.7 151.37 23.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.23 132.03 22.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 162.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.76 164.92 33.87 Favored Glycine 0 C--N 1.33 0.195 0 O-C-N 121.141 -0.974 . . . . 0.0 110.924 -178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -95.5 120.52 35.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -83.12 -158.67 0.29 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.591 1.156 . . . . 0.0 108.378 166.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.36 -17.86 77.88 Favored Glycine 0 CA--C 1.526 0.748 0 O-C-N 121.082 -1.011 . . . . 0.0 114.597 -170.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 44.0 t -150.88 -41.32 0.12 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.221 0.609 . . . . 0.0 109.666 162.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -103.47 105.7 16.03 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-O 122.17 0.986 . . . . 0.0 108.855 -170.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -60.11 148.95 34.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.298 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -139.43 174.14 10.82 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 124.595 1.158 . . . . 0.0 109.104 -163.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -155.54 166.09 34.6 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.456 1.903 . . . . 0.0 108.736 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.62 166.05 20.72 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.52 1.057 . . . . 0.0 110.537 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 p -72.33 166.1 23.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 118.383 1.092 . . . . 0.0 111.306 -177.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -142.01 175.27 9.87 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.621 0.768 . . . . 0.0 110.955 171.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.78 12.31 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.518 1.927 . . . . 0.0 109.737 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.27 99.33 12.37 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.216 1.807 . . . . 0.0 106.399 168.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.26 165.14 32.79 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.563 1.145 . . . . 0.0 108.413 173.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 37.3 t70 60.34 6.24 1.0 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.595 1.958 . . . . 0.0 114.92 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.2 27.91 69.88 Favored Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.119 -1.613 . . . . 0.0 111.696 -163.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.6 pttt -121.28 171.02 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.119 1.368 . . . . 0.0 109.089 166.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.3 tp -98.92 134.92 41.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 164.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.86 134.78 48.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 119.589 1.086 . . . . 0.0 108.538 166.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -90.41 -176.2 4.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.374 0.67 . . . . 0.0 110.362 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -120.92 -149.29 8.16 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 126.292 1.901 . . . . 0.0 109.508 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.9 t -69.66 85.98 0.47 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.5 mt -77.35 135.77 38.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.674 1.59 . . . . 0.0 109.363 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -169.32 168.88 41.59 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-O 121.638 0.577 . . . . 0.0 112.553 171.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.37 -168.83 13.25 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 125.1 1.333 . . . . 0.0 109.976 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.2 p -73.89 -179.05 3.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.54 1.136 . . . . 0.0 110.67 171.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -129.49 82.28 2.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.3 mtt -77.02 -175.87 3.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 167.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.84 110.69 16.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.081 0.953 . . . . 0.0 110.85 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 64.9 m -120.07 102.93 8.87 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 124.063 0.945 . . . . 0.0 108.552 164.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.45 57.16 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.643 2.777 . . . . 0.0 113.216 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -149.32 155.29 39.51 Favored Pre-proline 0 C--O 1.239 0.51 0 O-C-N 120.935 -1.103 . . . . 0.0 110.129 -161.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.62 -29.57 12.93 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.573 2.182 . . . . 0.0 111.126 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.11 -8.19 84.96 Favored Glycine 0 C--O 1.217 -0.945 0 CA-C-O 117.5 -1.722 . . . . 0.0 111.471 172.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.38 -59.12 2.07 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 120.769 2.284 . . . . 0.0 110.698 175.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.83 -12.26 60.25 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -165.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -65.15 -16.9 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 125.837 1.655 . . . . 0.0 113.335 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -45.38 -50.44 12.28 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.871 1.268 . . . . 0.0 111.319 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -56.52 -37.79 77.14 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-N 118.87 0.759 . . . . 0.0 112.179 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.25 63.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.256 1.028 . . . . 0.0 110.161 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -55.12 -48.09 74.1 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 15.0 mt -65.31 -38.73 91.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.938 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.08 -19.7 64.88 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -92.54 -43.95 8.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.734 1.214 . . . . 0.0 111.041 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.37 -18.14 60.78 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -175.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -72.63 -11.32 60.59 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.179 0.991 . . . . 0.0 113.066 174.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -124.45 56.39 1.28 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 120.333 1.424 . . . . 0.0 110.859 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.1 65.81 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.76 -31.61 59.61 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.193 -0.942 . . . . 0.0 109.997 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -124.19 162.81 22.86 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.004 1.321 . . . . 0.0 108.924 170.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.9 p -132.42 -163.7 1.37 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.081 0.952 . . . . 0.0 111.232 -162.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.8 83.5 0.04 OUTLIER Glycine 0 C--O 1.225 -0.463 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.998 156.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 5.2 p -97.86 151.0 4.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 119.109 1.454 . . . . 0.0 109.366 166.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.46 122.35 26.07 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 128.574 2.75 . . . . 0.0 104.474 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 4.0 ttm -114.01 42.55 2.02 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.752 2.021 . . . . 0.0 110.404 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -134.32 87.66 2.38 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.074 1.75 . . . . 0.0 107.973 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -47.72 133.79 10.93 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 125.897 1.679 . . . . 0.0 112.782 -162.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.66 122.61 7.92 Favored 'Cis proline' 0 C--N 1.346 0.441 0 CA-C-O 121.988 0.745 . . . . 0.0 113.083 4.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -82.06 126.77 32.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.346 1.058 . . . . 0.0 108.454 -174.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -141.73 149.16 40.14 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 55.5 ttp -126.98 141.57 51.76 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -170.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -112.82 150.06 32.19 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . 0.272 0.1 OUTLIER -127.21 153.07 46.55 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 127.036 2.134 . . . . 0.0 105.646 155.199 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 t -141.81 122.89 12.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 103.378 -2.823 . . . . 0.0 103.378 -176.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.4 169.29 17.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.122 0.963 . . . . 0.0 110.181 -176.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.5 p-10 -52.07 -26.73 11.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.675 164.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -2.66 45.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.991 1.269 . . . . 0.0 112.734 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.28 16.06 45.2 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 0.974 . . . . 0.0 114.549 166.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.67 172.25 5.44 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.301 -1.117 . . . . 0.0 108.862 171.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.9 m -146.82 116.55 7.17 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 119.095 -2.253 . . . . 0.0 109.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 161.16 14.5 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.646 1.178 . . . . 0.0 109.816 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 52.5 m -135.05 123.37 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.413 0.685 . . . . 0.0 110.195 -175.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -111.07 151.59 27.89 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 124.066 0.854 . . . . 0.0 111.531 165.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.59 150.4 20.75 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.843 1.257 . . . . 0.0 108.672 153.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -68.7 144.16 54.51 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 165.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.3 t -132.01 85.9 2.29 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 m -79.57 25.76 0.32 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.721 1.208 . . . . 0.0 110.67 167.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 . . . . . 0 C--O 1.247 0.952 0 C-N-CA 127.559 2.344 . . . . 0.0 110.571 -172.491 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -90.6 148.12 37.91 Favored Pre-proline 0 CA--C 1.536 0.434 0 O-C-N 120.764 -1.21 . . . . 0.0 112.624 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -65.0 -36.14 39.65 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.167 2.578 . . . . 0.0 110.498 169.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.7 21.56 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.87 2.068 . . . . 0.0 113.155 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -117.41 -18.58 9.8 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 120.177 -1.577 . . . . 0.0 111.722 169.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.3 m -72.24 -13.51 61.54 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.712 0.687 . . . . 0.0 111.89 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -79.96 2.09 24.9 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.044 1.338 . . . . 0.0 114.289 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.38 2.65 24.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.016 0.927 . . . . 0.0 110.427 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.88 -3.44 25.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.215 1.406 . . . . 0.0 111.964 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.07 -13.7 29.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 128.222 2.609 . . . . 0.0 113.531 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.66 -17.62 3.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.379 1.871 . . . . 0.0 112.582 -169.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.2 p -71.23 172.31 9.52 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.343 1.057 . . . . 0.0 111.281 -169.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 70.2 m -143.24 -57.82 0.41 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.325 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.5 m95 63.75 173.59 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.689 1.596 . . . . 0.0 113.982 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.1 t -142.96 127.45 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 175.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.2 tp -70.76 138.13 50.21 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -144.3 -20.71 0.55 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.88 155.63 49.54 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 120.595 1.543 . . . . 0.0 109.369 162.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -136.25 96.47 3.38 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 104.695 -2.335 . . . . 0.0 104.695 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -100.65 159.03 15.5 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 173.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -104.42 168.14 9.28 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 -174.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.15 -11.76 0.3 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.05 -3.33 12.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.63 1.104 . . . . 0.0 112.704 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.37 8.13 44.49 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 118.394 -1.226 . . . . 0.0 112.204 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.3 m -73.58 99.27 3.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.77 1.785 . . . . 0.0 109.025 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.67 110.92 2.18 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 163.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.9 mtt-85 -65.05 164.32 13.12 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.064 0.935 . . . . 0.0 108.936 169.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.63 144.04 28.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.049 165.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -146.17 163.05 32.43 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.038 2.135 . . . . 0.0 109.61 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.97 115.56 4.36 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 121.682 1.588 . . . . 0.0 109.825 170.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.69 172.77 10.83 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 122.957 0.503 . . . . 0.0 109.876 165.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.05 -44.67 79.06 Favored 'General case' 0 N--CA 1.462 0.168 0 O-C-N 121.61 -0.681 . . . . 0.0 109.943 172.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -65.38 -12.58 53.52 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -76.74 -5.07 46.57 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.579 -1.325 . . . . 0.0 113.095 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.72 -42.94 1.77 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 123.446 0.546 . . . . 0.0 112.407 167.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.89 82.74 63.32 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 125.286 1.435 . . . . 0.0 108.642 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.46 171.63 16.68 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 124.285 3.323 . . . . 0.0 111.452 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.9 mt -93.45 106.55 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 123.866 0.866 . . . . 0.0 109.594 176.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 p -81.59 162.46 23.12 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 166.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.21 163.71 26.11 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -154.89 129.26 9.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.507 -1.371 . . . . 0.0 109.54 178.017 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -135.1 66.2 1.53 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.272 1.429 . . . . 0.0 110.511 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -124.55 -172.86 2.65 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.134 0.974 . . . . 0.0 109.352 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.4 p -106.22 52.91 0.71 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.795 0.838 . . . . 0.0 110.31 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t -67.22 -21.5 65.75 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.984 -1.073 . . . . 0.0 112.76 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -96.4 1.59 51.86 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.404 1.456 . . . . 0.0 111.035 169.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.48 -1.04 10.11 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 126.146 1.831 . . . . 0.0 113.034 -167.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -99.47 172.34 7.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.889 1.844 . . . . 0.0 108.191 151.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -86.79 86.03 7.31 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 125.795 1.638 . . . . 0.0 107.078 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -120.02 106.54 12.11 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.331 1.452 . . . . 0.0 111.358 -162.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 143.69 44.63 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.922 2.089 . . . . 0.0 108.847 172.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.91 176.71 10.84 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 125.499 1.52 . . . . 0.0 108.384 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.68 163.49 20.52 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -89.46 109.84 20.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 162.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.5 t -85.62 172.62 10.76 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.396 0.998 . . . . 0.0 108.569 165.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.66 -40.15 6.37 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 126.499 2.0 . . . . 0.0 116.225 -155.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.4 t -116.62 -29.5 6.09 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.171 -0.605 . . . . 0.0 112.048 169.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -131.32 125.0 31.61 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.346 1.07 . . . . 0.0 108.468 -164.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 151.66 37.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.409 165.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -140.39 174.48 10.47 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.571 1.548 . . . . 0.0 109.131 -175.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.4 ptp -154.76 166.28 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 126.079 1.752 . . . . 0.0 109.684 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 167.0 -178.82 41.08 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.184 1.373 . . . . 0.0 111.151 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.6 p -108.86 120.09 41.48 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.951 -1.323 . . . . 0.0 110.963 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.2 p90 -88.94 -173.37 4.06 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -167.18 129.85 1.72 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.751 1.16 . . . . 0.0 109.723 166.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.0 139.28 34.63 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.621 0.646 . . . . 0.0 109.362 172.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 8.3 ptpt -168.94 157.72 8.22 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.409 1.884 . . . . 0.0 109.057 172.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 51.72 41.35 28.98 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.776 1.63 . . . . 0.0 113.735 170.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.11 1.98 11.86 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 120.145 -1.597 . . . . 0.0 114.09 -175.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -123.3 175.86 6.46 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 119.501 1.65 . . . . 0.0 110.731 -176.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 16.7 tp -114.82 124.79 52.64 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.9 p -107.44 153.52 22.69 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -121.31 153.51 37.62 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 125.486 1.515 . . . . 0.0 108.967 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -81.62 -175.43 50.27 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.064 0.84 . . . . 0.0 112.324 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -65.1 105.28 1.03 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 163.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 69.0 mt -88.94 166.71 13.75 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.594 0.757 . . . . 0.0 109.477 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.48 48.0 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.076 163.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -164.06 -121.06 0.55 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 76.6 p -128.15 -174.32 3.18 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.936 1.294 . . . . 0.0 109.944 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.3 mmm180 -130.46 45.46 2.81 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.224 1.81 . . . . 0.0 110.133 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.7 mtm -59.4 155.12 15.42 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.86 128.72 42.99 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 118.047 0.385 . . . . 0.0 111.053 -171.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 58.4 m -134.97 108.66 7.98 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 164.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 8.7 ptp -72.13 68.33 0.71 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 161.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 48.1 p -139.6 153.1 70.02 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.621 1.568 . . . . 0.0 108.394 173.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.88 -29.39 6.94 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.146 1.897 . . . . 0.0 110.561 174.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -72.9 -1.53 55.54 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-O 118.019 -1.434 . . . . 0.0 112.664 166.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -86.21 -58.53 1.96 Allowed Glycine 0 C--N 1.336 0.552 0 CA-C-N 119.552 1.676 . . . . 0.0 109.526 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.64 -10.19 43.49 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -167.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 tt -68.58 -15.5 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 O-C-N 121.32 -0.863 . . . . 0.0 111.935 174.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -44.83 -56.79 4.21 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.651 1.58 . . . . 0.0 110.959 173.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.6 -38.31 96.07 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-O 119.522 -0.599 . . . . 0.0 112.045 -177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.93 -41.77 82.03 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 117.696 0.748 . . . . 0.0 110.57 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -58.67 -51.7 68.81 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.231 1.013 . . . . 0.0 110.136 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.42 -42.61 78.3 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -11.02 60.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.76 -23.64 13.78 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 125.23 1.412 . . . . 0.0 111.049 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.88 64.49 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 120.025 1.284 . . . . 0.0 110.772 166.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 42.5 p -73.3 -1.31 17.47 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.17 -0.956 . . . . 0.0 111.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 -132.48 86.31 2.31 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.745 2.018 . . . . 0.0 106.854 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.9 mm -115.86 88.44 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 102.942 -2.984 . . . . 0.0 102.942 167.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -74.06 -42.11 60.7 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.469 -1.292 . . . . 0.0 108.796 169.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 -127.22 173.59 9.61 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.097 0.559 . . . . 0.0 110.98 -175.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 16.0 m -155.29 162.93 40.75 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 119.963 -1.71 . . . . 0.0 108.739 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.54 92.19 0.1 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 125.267 1.413 . . . . 0.0 109.737 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -90.87 135.64 26.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 118.195 0.998 . . . . 0.0 109.345 171.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -106.59 99.0 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 168.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 13.23 1.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.961 1.304 . . . . 0.0 112.697 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.81 132.12 54.44 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 126.782 2.033 . . . . 0.0 107.806 -175.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.91 124.45 58.3 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.273 1.429 . . . . 0.0 110.155 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.25 111.81 2.31 Favored 'Cis proline' 0 N--CA 1.457 -0.674 0 CA-C-N 120.364 1.166 . . . . 0.0 111.055 4.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -70.04 122.07 18.67 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -171.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -136.89 162.19 33.93 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.6 ttp -124.13 136.45 54.22 Favored 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 105.029 -2.211 . . . . 0.0 105.029 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -122.6 132.25 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 58.6 mt -136.55 153.65 50.93 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-O 122.884 1.326 . . . . 0.0 109.133 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.8 m -147.2 161.29 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.399 -3.001 0 CA-C-N 110.324 -3.126 . . . . 0.0 107.594 -160.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 8.4 mp -109.17 -174.58 2.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.494 -1.684 . . . . 0.0 107.56 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.73 -40.74 84.65 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 111.968 171.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -76.51 -20.63 56.73 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.495 0.589 . . . . 0.0 111.136 171.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.98 51.37 6.29 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 124.811 1.196 . . . . 0.0 112.826 -172.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . 0.408 ' C ' ' HG1' ' A' ' 137' ' ' THR . 7.7 m-20 -49.93 171.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 117.916 0.858 . . . . 0.0 109.704 149.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' THR . . . . . 0.408 ' HG1' ' C ' ' A' ' 136' ' ' ASP . 52.4 m -150.21 92.37 1.87 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 119.601 -1.937 . . . . 0.0 109.685 -163.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.6 mp -100.02 113.38 25.93 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.893 0.877 . . . . 0.0 109.878 -173.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.5 m -77.1 128.15 33.92 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 173.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -124.38 132.23 53.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 164.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -84.21 137.72 33.34 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.211 1.404 . . . . 0.0 108.255 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 132.15 51.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.735 1.152 . . . . 0.0 108.016 173.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.38 68.98 1.33 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.917 1.341 . . . . 0.0 107.917 170.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 52.3 m -87.31 38.82 0.84 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.759 1.624 . . . . 0.0 106.844 159.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 . . . . . 0 C--O 1.247 0.96 1 C-N-CA 132.508 4.323 . . . . 0.0 105.063 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 122.391 1.091 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -134.79 143.91 48.37 Favored Pre-proline 0 N--CA 1.435 -1.207 0 C-N-CA 124.805 1.242 . . . . 0.0 108.615 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.429 ' C ' ' H ' ' A' ' 19' ' ' ALA . 39.7 Cg_endo -70.29 -23.75 28.01 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 122.385 2.057 . . . . 0.0 110.67 166.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.45 14.07 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.841 2.057 . . . . 0.0 113.812 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.429 ' H ' ' C ' ' A' ' 17' ' ' PRO . . . -123.65 -12.22 7.68 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.121 2.168 . . . . 0.0 112.286 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.4 m -82.7 -16.21 48.99 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 119.151 0.887 . . . . 0.0 112.384 -174.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -76.08 -0.72 22.85 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.82 -1.175 . . . . 0.0 114.141 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.2 3.11 51.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.291 0.636 . . . . 0.0 110.773 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.48 32.78 0.16 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.678 1.991 . . . . 0.0 112.511 -171.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -94.07 -35.35 12.61 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.612 -1.305 . . . . 0.0 111.467 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -141.16 19.86 2.26 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 123.077 1.417 . . . . 0.0 109.868 -165.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.1 p -84.64 -170.58 3.19 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.887 -1.133 . . . . 0.0 108.268 167.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -152.37 -61.46 0.16 Allowed 'General case' 0 CA--C 1.506 -0.712 0 O-C-N 119.326 -2.109 . . . . 0.0 111.642 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 m95 65.9 159.46 0.12 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.81 1.767 . . . . 0.0 115.23 176.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.461 HG22 ' HG ' ' A' ' 143' ' ' SER . 22.3 t -135.22 125.05 43.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 128.287 2.635 . . . . 0.0 107.845 174.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.62 126.5 27.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 170.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -126.85 -19.51 4.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 118.887 0.767 . . . . 0.0 112.085 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.08 156.4 43.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.974 -1.079 . . . . 0.0 110.635 163.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -132.1 100.27 4.99 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.95 139.14 33.52 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -80.93 170.59 16.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.73 0.812 . . . . 0.0 109.953 166.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.69 -35.23 74.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.329 0.652 . . . . 0.0 112.341 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -75.9 -12.31 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.601 -0.687 . . . . 0.0 111.824 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.98 14.02 32.39 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-O 118.808 -0.995 . . . . 0.0 113.039 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -79.01 108.99 12.9 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.263 1.531 . . . . 0.0 109.095 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 114.58 5.31 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.406 -0.809 . . . . 0.0 109.102 164.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 -64.61 163.64 13.34 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 124.677 1.191 . . . . 0.0 110.808 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.99 134.14 52.3 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 155.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.6 m -132.01 159.7 70.97 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 166.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.64 114.24 3.43 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.744 1.63 . . . . 0.0 110.983 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -71.22 173.27 7.92 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.185 -0.947 . . . . 0.0 110.288 170.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.76 -35.58 66.37 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.471 -0.768 . . . . 0.0 111.758 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -73.15 -20.9 60.81 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.037 0.535 . . . . 0.0 112.347 -178.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -73.35 -14.56 61.31 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.619 -0.676 . . . . 0.0 112.006 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.74 -19.46 54.53 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 124.398 0.999 . . . . 0.0 114.397 167.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -131.53 71.09 81.48 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 123.967 0.907 . . . . 0.0 109.738 171.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -63.21 156.95 52.37 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 122.223 1.948 . . . . 0.0 110.057 172.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.7 mt -89.8 134.9 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -130.51 165.5 22.55 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -135.14 155.04 51.38 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 175.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.2 m -151.73 115.15 4.8 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.387 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.7 113.56 25.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 170.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -161.75 -174.42 4.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.6 p -134.29 27.82 3.77 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.533 1.133 . . . . 0.0 112.116 -171.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 63.8 m -44.93 -36.48 3.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.052 1.741 . . . . 0.0 114.286 172.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.9 t -72.96 -28.75 62.59 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.669 1.122 . . . . 0.0 111.143 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.01 -23.54 5.54 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 127.536 2.494 . . . . 0.0 111.962 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 -117.57 172.21 7.49 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.852 1.661 . . . . 0.0 109.57 177.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -61.57 93.46 0.04 OUTLIER 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.262 1.025 . . . . 0.0 110.552 167.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -131.06 120.63 23.7 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 126.546 1.938 . . . . 0.0 107.14 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.94 30.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.985 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.2 p -152.79 174.25 14.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 159.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 163.89 -165.3 36.92 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 174.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -121.12 127.66 51.81 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.411 ' H ' ' HA ' ' A' ' 73' ' ' ARG . 2.5 p -93.78 -7.15 44.31 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.246 1.418 . . . . 0.0 112.784 -175.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 143.67 -44.8 0.92 Allowed Glycine 0 C--N 1.336 0.556 0 CA-C-N 118.382 0.537 . . . . 0.0 112.005 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 5.4 p -157.98 -32.03 0.07 Allowed 'General case' 0 CA--C 1.52 -0.201 0 O-C-N 120.86 -1.376 . . . . 0.0 111.717 173.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.63 -0.02 46.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -173.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.411 ' HA ' ' H ' ' A' ' 69' ' ' SER 0.278 0.8 OUTLIER 48.01 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 127.471 2.308 . . . . 0.0 113.385 -175.211 . . . . . . . . 4 4 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -154.53 164.97 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.498 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.28 173.73 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.493 2.717 . . . . 0.0 107.707 167.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 148.53 174.69 20.44 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 125.628 1.585 . . . . 0.0 110.146 170.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.5 p -71.93 169.18 16.4 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.714 0.769 . . . . 0.0 110.755 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -148.99 174.78 11.91 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.471 0.708 . . . . 0.0 109.334 167.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.94 148.62 23.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.871 1.268 . . . . 0.0 108.983 169.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 114.4 26.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -151.11 166.26 31.35 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 53.55 13.4 0.47 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.233 1.813 . . . . 0.0 115.463 174.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.43 17.34 78.92 Favored Glycine 0 CA--C 1.531 1.059 0 O-C-N 120.495 -1.378 . . . . 0.0 112.56 -170.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -131.33 179.24 6.14 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 127.195 2.198 . . . . 0.0 110.129 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.05 109.39 20.82 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 104.433 -2.432 . . . . 0.0 104.433 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 57.6 p -97.45 152.82 18.58 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.019 0.827 . . . . 0.0 109.629 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.0 -164.81 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 110.266 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.9 -156.68 8.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 125.931 1.729 . . . . 0.0 111.595 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 t -74.71 71.03 1.91 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 172.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.1 mt -66.36 155.06 38.42 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.54 1.136 . . . . 0.0 108.096 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.85 -175.88 43.62 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 169.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.15 -149.72 5.18 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-O 121.794 0.663 . . . . 0.0 111.558 -167.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.3 p -100.18 -172.14 2.16 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 124.227 1.011 . . . . 0.0 109.993 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 mmt180 -135.5 87.84 2.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 171.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.3 mtt -114.42 165.2 12.97 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.633 1.173 . . . . 0.0 110.075 173.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.57 150.43 47.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 122.774 1.273 . . . . 0.0 110.602 163.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -145.09 147.16 32.24 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 130.411 3.484 . . . . 0.0 106.637 163.8 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ptp -129.09 28.6 5.27 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.953 1.701 . . . . 0.0 109.835 -177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.7 p -132.02 154.22 81.63 Favored Pre-proline 0 N--CA 1.446 -0.666 0 C-N-CA 125.953 1.701 . . . . 0.0 107.663 -168.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.15 -41.93 11.89 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.303 1.335 . . . . 0.0 109.348 176.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -62.51 -17.14 56.51 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-O 118.003 -1.443 . . . . 0.0 113.268 176.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.86 -56.11 12.01 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 120.102 1.951 . . . . 0.0 110.869 167.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -73.94 -18.39 60.9 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.471 1.136 . . . . 0.0 113.047 -162.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 18.2 tt -66.77 -13.72 16.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 123.278 0.631 . . . . 0.0 111.403 172.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -50.06 -43.24 51.06 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 125.426 1.49 . . . . 0.0 111.439 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.71 -42.6 98.01 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-O 119.417 -0.657 . . . . 0.0 111.611 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.61 69.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.632 0.716 . . . . 0.0 109.638 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.72 -54.48 38.61 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.993 0.917 . . . . 0.0 110.477 -175.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.48 -50.05 66.18 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 174.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -48.31 74.23 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.89 0.314 . . . . 0.0 111.225 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.01 64.43 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.232 1.013 . . . . 0.0 112.88 -173.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.08 -14.72 61.45 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.782 1.174 . . . . 0.0 112.293 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 26.4 p -84.46 4.39 31.89 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 119.287 0.949 . . . . 0.0 111.368 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -133.38 80.88 1.9 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.43 2.292 . . . . 0.0 108.659 -171.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -118.03 51.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 119.331 0.969 . . . . 0.0 109.959 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.95 -32.58 73.02 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.973 -1.079 . . . . 0.0 111.622 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -128.32 168.09 16.02 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.182 1.393 . . . . 0.0 109.789 -175.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 t -162.97 -179.01 6.44 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.598 -164.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 172.3 69.79 0.04 OUTLIER Glycine 0 CA--C 1.534 1.221 0 CA-C-N 118.993 0.815 . . . . 0.0 114.279 -176.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.15 142.05 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-N 120.797 2.298 . . . . 0.0 109.078 171.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -105.76 96.2 6.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 166.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 32.2 tpp -81.96 60.62 4.88 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 110.14 2.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -48.23 132.34 12.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.893 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.57 119.82 5.5 Favored 'Cis proline' 0 C--N 1.347 0.493 0 CA-C-N 119.543 0.872 . . . . 0.0 111.3 -0.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.07 136.69 37.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -140.91 165.87 26.34 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.82 2.448 . . . . 0.0 105.605 171.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 27.7 ttp -131.29 128.88 40.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 174.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -112.62 146.39 38.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 169.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 37.5 mt -135.11 139.99 45.12 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 73.9 t -129.07 126.24 64.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 -168.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.9 mp -73.95 165.92 24.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 122.666 1.222 . . . . 0.0 108.733 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -58.01 -36.12 72.22 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.724 1.21 . . . . 0.0 109.892 167.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -72.04 -19.86 61.77 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.895 1.678 . . . . 0.0 110.498 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.44 12.54 57.06 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-O 118.307 -1.274 . . . . 0.0 114.388 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.33 145.59 47.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.09 1.945 . . . . 0.0 107.423 164.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 15.1 m -125.12 96.6 4.91 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 124.947 1.299 . . . . 0.0 109.163 -177.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.54 127.58 33.0 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.072 -1.018 . . . . 0.0 108.333 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 36.7 m -113.95 118.52 34.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.391 1.877 . . . . 0.0 107.644 -175.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -114.74 150.58 35.12 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.148 1.379 . . . . 0.0 108.785 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.13 149.3 21.57 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.279 1.031 . . . . 0.0 108.986 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.0 tpt85 -71.48 107.11 4.23 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 163.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' SER . . . . . 0.461 ' HG ' HG22 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.68 89.03 2.97 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 170.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 t -115.57 50.34 1.01 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 122.038 0.923 . . . . 0.0 108.91 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.019 -1.467 . . . . 0.0 107.778 -179.213 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 111.585 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.07 144.71 58.2 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.215 1.406 . . . . 0.0 111.175 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.436 ' C ' ' H ' ' A' ' 19' ' ' ALA . 89.8 Cg_endo -79.18 -26.15 5.36 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.634 2.89 . . . . 0.0 111.474 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.69 30.32 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.114 1.365 . . . . 0.0 112.538 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 17' ' ' PRO . . . -120.71 -11.06 9.08 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.303 2.641 . . . . 0.0 110.558 173.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -59.63 -39.17 83.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.122 0.969 . . . . 0.0 112.389 -169.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -28.16 69.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.675 -1.265 . . . . 0.0 113.072 177.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.3 mp -81.86 34.68 0.4 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.947 1.699 . . . . 0.0 110.108 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.35 -6.45 17.16 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.461 1.105 . . . . 0.0 110.898 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -60.77 -27.81 68.26 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.294 1.837 . . . . 0.0 114.901 -166.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -102.14 -14.09 17.2 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.621 1.568 . . . . 0.0 113.083 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.2 p -89.43 174.88 7.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.756 -149.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 3.9 p -124.12 -73.96 0.63 Allowed 'General case' 0 CA--C 1.503 -0.84 0 O-C-N 121.13 -0.981 . . . . 0.0 112.388 -171.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 6.6 m95 69.82 162.68 0.23 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.584 1.954 . . . . 0.0 111.421 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.6 t -144.3 135.3 21.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 177.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.23 131.85 40.67 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.9 t -116.96 -26.17 6.97 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.626 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -153.87 146.38 24.07 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 121.325 1.875 . . . . 0.0 112.458 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -137.98 101.63 4.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 127.808 2.443 . . . . 0.0 107.36 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -84.8 131.87 34.49 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 169.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.82 167.12 17.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 163.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.28 -29.72 66.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.114 0.884 . . . . 0.0 112.459 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.29 -16.83 28.52 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.757 0.708 . . . . 0.0 112.582 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.2 -1.81 11.56 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.703 1.144 . . . . 0.0 113.4 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 m -64.33 93.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.667 1.734 . . . . 0.0 109.096 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.4 107.22 0.63 Allowed 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.677 -1.264 . . . . 0.0 109.719 169.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.45 142.75 57.73 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.63 130.94 41.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.7 m -128.77 153.88 79.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 174.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -70.1 113.32 3.39 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.129 1.219 . . . . 0.0 110.26 -177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -62.14 169.15 2.88 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.338 0.655 . . . . 0.0 110.664 166.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.35 62.53 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.978 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -102.01 -9.26 20.77 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -68.81 -15.26 63.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.268 -0.872 . . . . 0.0 112.024 173.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.67 -79.57 0.28 Allowed Glycine 0 C--N 1.336 0.551 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.26 86.18 58.58 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 128.211 2.604 . . . . 0.0 108.13 -168.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.85 160.21 47.89 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.443 2.096 . . . . 0.0 111.594 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 26.6 mt -75.17 103.56 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 176.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 p -103.29 157.81 16.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.599 0.759 . . . . 0.0 109.644 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -127.21 157.92 38.51 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.516 1.127 . . . . 0.0 109.223 169.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -141.7 128.15 20.06 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.547 1.539 . . . . 0.0 108.328 163.205 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.98 121.13 38.53 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 126.457 1.903 . . . . 0.0 106.159 161.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -151.57 -167.72 2.88 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 173.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 p -131.26 21.82 4.81 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.755 1.622 . . . . 0.0 111.277 -171.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.3 t -63.28 -29.76 71.03 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.226 1.41 . . . . 0.0 113.819 -165.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -78.99 -10.73 59.92 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.098 -1.001 . . . . 0.0 111.346 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.16 -6.35 58.07 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 125.803 1.668 . . . . 0.0 111.667 -169.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -132.3 166.93 20.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.533 1.533 . . . . 0.0 110.215 -176.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.2 ptp85 -66.04 74.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.815 2.046 . . . . 0.0 111.944 173.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.25 140.9 36.78 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.39 148.11 38.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.3 p -152.3 166.75 30.83 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.58 -169.4 40.4 Favored Glycine 0 C--N 1.331 0.29 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.26 132.96 51.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 169.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.2 m -114.52 22.88 13.24 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.475 1.91 . . . . 0.0 110.836 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.56 -73.5 0.46 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-O 117.287 -1.84 . . . . 0.0 112.08 178.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -144.51 -4.92 0.76 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 121.579 2.69 . . . . 0.0 113.878 179.591 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.454 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 16.3 m120 -115.97 -6.27 11.99 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.226 1.411 . . . . 0.0 114.268 -172.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 61.98 174.86 0.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 131.493 3.917 . . . . 0.0 111.74 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -147.68 161.2 41.65 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.369 0.604 . . . . 0.0 111.719 170.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.8 164.83 37.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.576 2.351 . . . . 0.0 108.266 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.07 173.98 27.18 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 174.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.0 p -89.33 160.64 16.77 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 122.123 -0.633 . . . . 0.0 109.755 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -140.26 -174.62 3.99 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.756 -0.59 . . . . 0.0 111.75 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -153.19 165.76 34.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.627 1.571 . . . . 0.0 108.542 166.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 79.5 mt -128.88 105.43 8.22 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -163.08 170.34 18.08 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 126.181 1.792 . . . . 0.0 108.65 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.62 21.7 7.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.061 1.344 . . . . 0.0 112.966 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.36 19.88 64.8 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 118.467 -1.185 . . . . 0.0 112.653 -171.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -139.78 178.74 7.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.397 1.599 . . . . 0.0 111.19 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 tt -115.41 113.37 23.66 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.14 134.09 36.95 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 170.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -88.69 -172.78 3.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.08 -149.01 7.91 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 126.664 2.078 . . . . 0.0 109.641 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.0 t -61.56 110.34 1.45 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 mt -88.21 169.62 11.72 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.333 1.453 . . . . 0.0 109.4 171.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.55 177.59 46.51 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 158.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.1 -173.68 25.84 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 70.1 p -71.4 179.45 2.94 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.889 0.876 . . . . 0.0 111.425 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.49 47.65 2.51 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.183 1.393 . . . . 0.0 108.297 172.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.7 mtm -63.1 157.08 23.15 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -112.1 129.82 56.1 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 96.9 m -136.71 125.74 24.4 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.883 2.073 . . . . 0.0 108.319 -169.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.5 mtp -90.73 53.06 2.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.994 0.902 . . . . 0.0 109.795 -174.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.7 p -134.55 153.29 78.99 Favored Pre-proline 0 C--O 1.239 0.507 0 C-N-CA 124.394 1.077 . . . . 0.0 108.25 -170.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -72.63 -37.77 3.78 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.257 1.305 . . . . 0.0 108.883 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.07 15.64 6.36 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 118.056 -1.413 . . . . 0.0 111.933 172.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -113.19 -11.0 14.3 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-N 120.504 2.152 . . . . 0.0 111.855 163.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -88.39 -21.06 24.5 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 169.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.4 tt -71.16 -14.1 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 120.093 1.315 . . . . 0.0 113.179 -169.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.454 ' CD ' ' H ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -57.34 -41.44 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 121.004 -1.06 . . . . 0.0 112.516 -172.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.12 -47.44 87.57 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 124.346 0.974 . . . . 0.0 111.249 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.39 -51.42 67.62 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.755 0.778 . . . . 0.0 109.678 177.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -64.5 -40.57 95.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.487 0.315 . . . . 0.0 111.359 -170.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.3 mp -61.5 -37.19 82.78 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 121.256 -0.903 . . . . 0.0 110.467 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -21.16 65.07 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.36 -39.74 20.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.0 -13.5 35.99 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.134 0.974 . . . . 0.0 113.141 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 46.9 p -97.84 8.89 43.96 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.01 1.324 . . . . 0.0 110.838 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -134.96 65.21 1.57 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 109.637 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -100.85 79.37 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 169.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.83 -36.52 78.3 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 118.699 -1.2 . . . . 0.0 110.211 170.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.466 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -130.69 161.27 32.02 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.444 1.098 . . . . 0.0 110.966 -174.701 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.6 m -149.25 169.74 20.06 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 158.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -159.71 162.16 32.79 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 108.09 -2.004 . . . . 0.0 108.09 153.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 45.0 t -124.74 145.04 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -110.08 93.3 4.43 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 170.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.2 mtp -80.2 35.2 0.32 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.442 1.097 . . . . 0.0 111.495 176.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -132.12 124.71 29.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 -178.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.62 148.83 65.17 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.973 0.909 . . . . 0.0 110.573 -173.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.9 122.39 5.6 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 N-CA-C 108.895 -1.233 . . . . 0.0 108.895 -14.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -71.52 135.24 46.99 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.11 0.481 . . . . 0.0 110.705 -168.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -139.26 168.81 18.99 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.799 1.24 . . . . 0.0 109.282 174.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -132.2 143.63 50.08 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.666 1.986 . . . . 0.0 106.843 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -138.01 139.39 39.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.883 0.849 . . . . 0.0 110.333 -174.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.429 ' N ' ' CD1' ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -134.09 161.12 35.75 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 127.675 2.39 . . . . 0.0 109.516 176.881 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.466 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 25.2 t -133.54 136.55 54.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 103.642 -2.725 . . . . 0.0 103.642 172.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 1.4 mp -82.71 162.1 21.89 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 172.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -66.11 -26.57 67.52 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.483 0.659 . . . . 0.0 111.731 -173.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.36 -5.92 58.36 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.615 1.566 . . . . 0.0 111.619 176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 103.22 4.41 47.38 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.997 -1.446 . . . . 0.0 115.441 169.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -62.07 158.46 16.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.589 1.695 . . . . 0.0 109.25 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.0 m -128.54 115.25 17.83 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.806 1.242 . . . . 0.0 109.981 -176.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -116.03 152.23 33.96 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.722 -0.611 . . . . 0.0 109.61 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 98.1 m -145.49 119.79 9.58 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.567 -164.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -113.82 140.25 48.47 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 123.518 0.727 . . . . 0.0 110.28 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.4 136.11 33.98 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.415 1.486 . . . . 0.0 107.708 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -60.91 136.93 58.23 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 117.803 -1.094 . . . . 0.0 108.21 174.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' SER . . . . . 0.439 ' C ' ' H ' ' A' ' 145' ' ' ARG . 8.0 t -138.42 35.91 2.27 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 119.661 1.118 . . . . 0.0 111.189 172.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.9 m -76.75 25.21 0.14 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.943 1.297 . . . . 0.0 109.822 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 143' ' ' SER . 57.7 ttt180 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 127.85 2.46 . . . . 0.0 111.736 171.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 121.695 0.759 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -112.0 144.14 30.13 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.749 -170.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.46 -26.42 14.22 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.049 3.166 . . . . 0.0 111.902 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.77 49.82 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.584 171.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -156.16 -43.57 0.08 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.919 2.487 . . . . 0.0 108.26 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 m -60.8 -16.9 45.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.994 2.517 . . . . 0.0 114.206 -164.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -74.44 -24.05 59.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.943 1.697 . . . . 0.0 113.466 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -72.42 -4.42 30.08 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.467 1.507 . . . . 0.0 111.155 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 38.98 0.57 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.875 1.27 . . . . 0.0 111.278 -160.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.77 -51.54 7.14 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.692 0.797 . . . . 0.0 110.756 175.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.07 -3.09 28.16 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.211 1.004 . . . . 0.0 112.232 -158.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.61 167.24 11.6 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 123.059 1.409 . . . . 0.0 111.584 -156.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.9 p -141.72 155.69 45.64 Favored 'General case' 0 CA--C 1.496 -1.122 0 O-C-N 120.07 -1.644 . . . . 0.0 106.822 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.407 ' CE3' ' HB2' ' A' ' 128' ' ' MET . 9.1 m95 -145.62 169.07 19.16 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.433 -175.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.0 t -136.02 124.03 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 169.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -79.98 129.82 34.79 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -178.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 -7.78 3.57 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.91 141.7 19.05 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-N 119.666 1.121 . . . . 0.0 111.389 173.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.412 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -127.47 118.81 24.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 128.562 2.745 . . . . 0.0 106.19 174.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -98.71 130.75 45.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -66.28 168.26 9.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 118.359 0.527 . . . . 0.0 109.793 163.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.13 71.61 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.479 1.111 . . . . 0.0 112.14 -174.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -23.57 63.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.811 0.339 . . . . 0.0 110.733 -177.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 110.33 3.14 29.4 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.663 2.078 . . . . 0.0 112.248 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.6 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.049 1.424 . . . . 0.0 108.807 177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.14 115.92 4.15 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 168.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.44 168.87 15.21 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.082 0.553 . . . . 0.0 109.623 172.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.75 152.3 27.06 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 151.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.4 m -140.36 165.65 28.79 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 125.983 1.713 . . . . 0.0 108.492 170.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.46 105.77 0.94 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.005 2.47 . . . . 0.0 110.454 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.406 ' H ' ' HG3' ' A' ' 48' ' ' GLN . 0.7 OUTLIER -73.18 174.87 7.37 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.563 1.145 . . . . 0.0 111.352 167.798 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.76 -49.33 76.93 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.932 0.493 . . . . 0.0 112.241 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.24 3.96 52.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 45' ' ' SER . 27.3 mm-40 -70.22 -24.99 63.19 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.328 -0.857 . . . . 0.0 110.641 171.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.66 -44.38 0.72 Allowed Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.306 0.955 . . . . 0.0 112.533 173.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.29 85.44 5.41 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 127.198 2.199 . . . . 0.0 109.953 -165.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -69.53 138.6 38.94 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 123.176 2.584 . . . . 0.0 112.807 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.4 mt -62.95 119.43 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.927 0.891 . . . . 0.0 109.61 163.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -124.37 119.28 28.79 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 172.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.35 144.23 48.34 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.911 1.284 . . . . 0.0 108.608 173.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.9 m -148.77 103.02 3.34 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 166.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -82.26 126.81 32.54 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 162.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.7 t -170.25 -159.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.89 51.2 1.13 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.932 0.893 . . . . 0.0 112.231 171.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.1 t -57.88 -39.5 77.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.395 1.078 . . . . 0.0 112.526 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.46 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 3.6 t -81.33 -10.93 59.46 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.571 0.748 . . . . 0.0 112.361 174.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.09 -12.25 40.77 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.177 1.37 . . . . 0.0 112.87 -173.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -120.87 162.32 20.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.591 1.695 . . . . 0.0 110.168 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.4 ptp85 -63.06 94.97 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.553 0.741 . . . . 0.0 110.861 176.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.46 ' CE1' ' HB ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -138.7 154.41 48.58 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.144 0.973 . . . . 0.0 109.284 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.96 92.86 9.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -169.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.2 p -98.09 66.49 1.83 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 122.257 1.027 . . . . 0.0 109.84 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.06 161.29 26.63 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 29.4 t80 -88.0 119.41 28.34 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 157.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -83.92 176.57 8.79 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 160.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.77 11.16 6.1 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.958 1.266 . . . . 0.0 115.374 -155.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -159.38 3.29 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 141.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -135.84 125.69 25.73 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 106.135 -1.802 . . . . 0.0 106.135 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -69.5 139.61 53.88 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.772 -0.58 . . . . 0.0 110.03 168.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -112.74 169.04 9.18 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 126.236 1.814 . . . . 0.0 108.86 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.7 ptp -157.5 146.47 19.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.054 1.742 . . . . 0.0 107.516 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.56 156.33 7.97 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.571 -0.612 . . . . 0.0 111.571 168.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -94.83 120.5 35.15 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 122.613 0.365 . . . . 0.0 111.969 -146.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 41.3 p90 -98.0 171.09 8.49 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.195 0.522 . . . . 0.0 112.175 -169.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.51 145.67 25.35 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 126.738 2.015 . . . . 0.0 107.993 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.73 117.43 29.32 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 170.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -159.23 3.12 0.09 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -173.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -137.82 9.65 2.84 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.088 0.955 . . . . 0.0 113.454 -161.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.97 11.4 50.93 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.252 -1.53 . . . . 0.0 112.01 -157.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -137.87 165.94 25.25 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 126.93 2.092 . . . . 0.0 109.49 169.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -75.08 146.52 41.4 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 128.362 2.665 . . . . 0.0 107.375 163.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m -127.47 138.14 52.87 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 153.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -85.48 164.12 18.03 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.14 -171.65 44.45 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.108 -1.997 . . . . 0.0 108.108 165.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 m -58.37 106.53 0.39 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 165.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.4 mt -82.81 156.37 23.69 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -154.2 167.01 32.27 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 165.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.09 179.46 21.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.613 0.707 . . . . 0.0 111.901 -174.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.0 p -67.18 172.13 5.01 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -120.52 77.34 1.26 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 169.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 30.5 mtt -76.86 158.78 30.55 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -98.11 111.89 24.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.219 1.408 . . . . 0.0 108.243 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 77.9 m -145.58 129.08 16.99 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.847 0.832 . . . . 0.0 110.998 -167.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.3 mtm -107.54 57.17 0.63 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.115 1.766 . . . . 0.0 107.521 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.8 p -142.58 150.79 55.49 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 123.34 0.656 . . . . 0.0 110.396 -164.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.99 -21.76 31.98 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.26 1.974 . . . . 0.0 111.236 176.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.86 -14.88 68.88 Favored Glycine 0 CA--C 1.524 0.645 0 C-N-CA 124.723 1.154 . . . . 0.0 112.935 173.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 -38.98 68.67 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 118.582 1.191 . . . . 0.0 111.411 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -92.5 -26.24 18.04 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.621 0.71 . . . . 0.0 112.445 -173.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.72 -14.15 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 119.388 0.995 . . . . 0.0 111.451 174.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -50.34 -43.87 54.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.121 0.969 . . . . 0.0 110.551 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.84 97.56 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.565 -0.614 . . . . 0.0 111.565 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.89 -37.11 75.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 117.622 0.711 . . . . 0.0 110.522 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -62.47 -48.77 78.14 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.567 0.747 . . . . 0.0 109.992 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.0 -33.04 74.57 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.89 0.768 . . . . 0.0 110.737 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.22 -32.96 74.71 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.964 0.802 . . . . 0.0 111.992 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.73 72.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 123.367 0.667 . . . . 0.0 109.545 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -13.8 50.24 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 117.435 -1.269 . . . . 0.0 113.574 175.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 p -79.9 -9.46 59.68 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 121.012 1.733 . . . . 0.0 111.686 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -121.14 26.78 8.78 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.458 1.103 . . . . 0.0 112.386 -163.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.2 mm -68.54 90.92 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -90.13 -25.56 20.64 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 121.569 -0.707 . . . . 0.0 111.108 169.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -133.87 166.65 22.19 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 126.167 1.787 . . . . 0.0 110.307 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 m -160.21 146.59 15.67 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.54 1.536 . . . . 0.0 107.932 174.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -125.37 138.06 10.71 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 160.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.41 144.24 23.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 164.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -124.79 76.99 1.56 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 -173.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.5 mtp -81.16 27.31 0.41 Allowed 'General case' 0 C--O 1.23 0.069 0 C-N-CA 126.314 1.846 . . . . 0.0 113.821 -174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -121.51 109.06 14.37 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -51.52 126.22 29.53 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 124.271 1.029 . . . . 0.0 110.629 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.39 120.59 6.58 Favored 'Cis proline' 0 CA--C 1.534 0.52 0 O-C-N 122.63 0.805 . . . . 0.0 112.725 6.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -82.95 137.57 34.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.835 -0.541 . . . . 0.0 110.409 -170.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -142.51 175.85 9.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 107.573 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' MET . . . . . 0.407 ' HB2' ' CE3' ' A' ' 28' ' ' TRP . 7.1 tmm? -128.25 157.44 40.88 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 126.725 2.01 . . . . 0.0 105.937 172.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -155.15 112.03 3.27 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 169.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.411 HD13 ' H ' ' A' ' 138' ' ' LEU 0.333 0.4 OUTLIER -80.97 163.94 22.93 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 172.627 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.9 t -135.93 130.99 49.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 104.74 -2.319 . . . . 0.0 104.74 166.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 14.5 mt -83.11 164.8 20.03 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -54.7 -37.08 65.38 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.21 1.004 . . . . 0.0 111.679 173.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -80.22 -14.57 58.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.342 1.057 . . . . 0.0 111.993 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.38 -7.61 34.68 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.603 1.097 . . . . 0.0 114.613 174.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -55.02 144.65 22.75 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.265 1.532 . . . . 0.0 108.666 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.3 m -135.54 110.94 9.09 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 125.294 1.438 . . . . 0.0 108.013 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' A' ' 33' ' ' TRP . 0.1 OUTLIER -105.86 155.83 18.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 121.254 -0.903 . . . . 0.0 108.938 176.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 89.5 m -132.78 114.93 14.69 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.094 1.497 . . . . 0.0 108.946 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -124.81 139.54 53.75 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.79 142.65 27.13 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 123.787 0.835 . . . . 0.0 109.078 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -65.68 119.5 11.28 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 116.382 -1.771 . . . . 0.0 109.694 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 5.7 t -124.08 38.34 4.21 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.671 2.032 . . . . 0.0 113.217 -172.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.3 p -74.89 17.2 0.23 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.753 1.221 . . . . 0.0 112.214 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.973 0 C-N-CA 125.118 1.367 . . . . 0.0 113.292 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 . . . . . 0 C--O 1.233 0.221 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.455 HD21 ' HB1' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -147.39 149.79 35.55 Favored Pre-proline 0 CA--C 1.532 0.269 0 O-C-N 121.591 -0.693 . . . . 0.0 111.052 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.37 -32.34 8.2 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 123.891 3.06 . . . . 0.0 111.103 170.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.455 ' HB1' HD21 ' A' ' 16' ' ' ASN . . . -69.3 40.78 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.007 2.123 . . . . 0.0 112.243 175.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.03 -17.26 0.67 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.845 1.658 . . . . 0.0 112.069 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -31.64 72.22 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.49 1.496 . . . . 0.0 111.272 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -57.73 -20.47 34.8 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -173.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.33 6.23 38.16 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.638 1.175 . . . . 0.0 111.158 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -89.97 78.09 6.8 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.404 1.482 . . . . 0.0 108.373 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -134.45 -27.78 1.33 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -128.24 0.93 5.77 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.954 1.702 . . . . 0.0 111.118 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.9 p -74.27 -172.76 1.5 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 125.692 1.597 . . . . 0.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.4 OUTLIER -151.24 -63.9 0.19 Allowed 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.453 -1.404 . . . . 0.0 110.536 -176.41 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.2 m95 65.12 159.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 123.227 1.489 . . . . 0.0 112.438 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.5 t -140.97 129.61 24.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 103.744 -2.687 . . . . 0.0 103.744 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.6 tp -66.91 154.8 40.11 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.09 -20.8 0.25 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.46 -1.4 . . . . 0.0 111.67 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.26 140.05 29.0 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 118.753 0.706 . . . . 0.0 109.824 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -118.03 98.61 6.41 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.536 1.134 . . . . 0.0 108.442 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.55 134.33 34.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 37' ' ' ASP . 26.8 mt-30 -74.96 166.96 22.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 123.011 0.524 . . . . 0.0 109.599 169.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.38 16.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 129.395 3.078 . . . . 0.0 115.226 172.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.477 ' H ' ' C ' ' A' ' 35' ' ' GLN . 0.2 OUTLIER -129.6 -18.38 3.53 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.377 2.271 . . . . 0.0 111.202 -179.487 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.14 3.99 35.74 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.255 0.931 . . . . 0.0 113.914 -175.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.7 m -88.08 113.27 23.55 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.615 1.566 . . . . 0.0 111.747 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.48 108.82 2.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.767 1.227 . . . . 0.0 113.343 165.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.11 161.51 8.53 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 126.096 1.758 . . . . 0.0 112.09 176.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 128.65 38.15 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 117.995 -1.002 . . . . 0.0 108.59 161.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.46 163.57 33.45 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 126.027 1.731 . . . . 0.0 108.318 174.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.2 107.59 2.23 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.652 2.235 . . . . 0.0 110.756 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.99 169.48 6.73 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.213 1.005 . . . . 0.0 111.536 170.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.96 -54.8 32.79 Favored 'General case' 0 C--O 1.231 0.124 0 O-C-N 121.632 -0.668 . . . . 0.0 110.451 175.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -10.53 52.56 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -176.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -75.99 -17.33 59.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.102 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.7 -88.34 0.2 Allowed Glycine 0 C--N 1.337 0.636 0 CA-C-N 119.306 0.957 . . . . 0.0 110.73 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.96 86.12 19.1 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.324 2.25 . . . . 0.0 109.129 -170.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -71.66 175.31 9.74 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.811 2.341 . . . . 0.0 112.079 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.85 110.38 22.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 127.915 2.486 . . . . 0.0 109.276 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 p -114.91 117.59 31.08 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.74 1.616 . . . . 0.0 109.072 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -81.99 165.33 20.78 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 3.6 m -145.55 134.78 22.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 163.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -119.99 97.87 5.81 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 174.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.3 t -150.66 159.36 44.56 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -176.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -108.46 59.56 0.61 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.896 0.771 . . . . 0.0 109.924 -173.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -32.79 69.53 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.129 -0.357 . . . . 0.0 111.092 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.4 p -90.53 10.18 26.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 111.516 177.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.87 -14.24 0.41 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 125.649 1.595 . . . . 0.0 113.596 -164.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.39 157.69 15.78 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 177.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.6 ptp85 -68.29 72.67 0.2 Allowed 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 126.17 1.788 . . . . 0.0 111.75 175.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 132.64 34.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.928 1.291 . . . . 0.0 110.854 176.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.7 118.04 36.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.14 154.89 50.15 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 168.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.33 169.68 42.56 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -175.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -96.96 125.49 41.42 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.475 ' HB2' ' CE2' ' A' ' 108' ' ' TYR . 28.3 t -109.27 91.1 3.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.949 0.795 . . . . 0.0 109.218 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 84.18 -64.84 4.2 Favored Glycine 0 C--N 1.332 0.355 0 CA-C-O 118.613 -1.104 . . . . 0.0 110.994 151.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -134.41 -1.07 2.89 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.647 1.224 . . . . 0.0 111.854 163.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -144.73 118.86 9.45 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.532 1.133 . . . . 0.0 108.493 -163.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.44 160.86 27.5 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.762 -1.211 . . . . 0.0 113.325 173.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -133.35 170.38 15.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.567 2.747 . . . . 0.0 112.061 -176.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -153.59 166.78 31.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.612 1.565 . . . . 0.0 111.597 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.69 -163.84 30.52 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.661 1.601 . . . . 0.0 110.25 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.4 m -127.71 155.26 44.26 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.373 1.469 . . . . 0.0 109.824 -164.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . 0.411 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 52.3 p90 -138.97 179.47 6.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -174.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.82 148.2 30.65 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.297 1.839 . . . . 0.0 109.578 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 mp -117.31 103.78 10.49 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.248 2.219 . . . . 0.0 107.089 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.39 -175.08 5.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.549 168.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 53.42 16.19 0.84 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 165.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.81 14.26 58.03 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.051 -1.656 . . . . 0.0 114.285 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.4 pttt -132.72 160.73 35.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.716 1.758 . . . . 0.0 111.26 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.51 102.83 12.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 p -97.75 132.55 43.27 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.501 0.721 . . . . 0.0 109.077 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -96.19 -176.76 3.76 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.868 1.267 . . . . 0.0 109.944 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.67 -153.79 8.91 Favored Glycine 0 CA--C 1.521 0.45 0 C-N-CA 125.624 1.583 . . . . 0.0 111.062 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -64.27 85.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 123.228 1.489 . . . . 0.0 107.747 166.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 mt -78.34 178.31 7.77 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 119.923 -1.736 . . . . 0.0 108.52 169.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.97 -171.88 27.58 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 125.889 1.709 . . . . 0.0 109.41 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -179.43 -124.91 0.91 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 119.973 -1.108 . . . . 0.0 114.48 -171.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.1 p -102.59 169.67 8.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.346 1.058 . . . . 0.0 110.277 -165.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . 0.307 0.0 OUTLIER -128.05 40.91 3.59 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.294 1.038 . . . . 0.0 110.389 -174.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.0 mtt -58.8 140.9 54.44 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -91.14 124.89 35.7 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 91.3 m -136.99 169.09 18.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.121 1.368 . . . . 0.0 109.266 176.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.2 mtp -127.1 23.92 6.44 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.462 0.705 . . . . 0.0 110.26 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 43.8 p -101.89 158.75 31.17 Favored Pre-proline 0 C--O 1.238 0.481 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -168.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.22 -12.09 23.17 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.027 1.152 . . . . 0.0 112.159 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -92.61 -0.34 69.65 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 117.776 -1.569 . . . . 0.0 113.558 171.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.72 -45.67 4.19 Favored Glycine 0 CA--C 1.524 0.649 0 CA-C-N 120.239 2.019 . . . . 0.0 112.13 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -73.34 -22.5 60.29 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.812 1.306 . . . . 0.0 111.746 -174.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.7 tt -63.13 -14.33 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 O-C-N 121.503 -0.748 . . . . 0.0 112.352 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.466 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 5.3 tm-20 -66.56 -4.02 7.62 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.759 173.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.95 -64.17 1.9 Allowed Glycine 0 CA--C 1.533 1.214 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 164.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -33.29 74.47 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.287 -1.125 . . . . 0.0 112.626 -169.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 69' ' ' SER . 0.4 OUTLIER -63.6 -36.59 84.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.503 0.721 . . . . 0.0 110.428 -171.398 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.449 HD13 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -75.43 -23.21 56.93 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.694 1.198 . . . . 0.0 111.117 176.65 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.18 -24.17 40.51 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 171.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.95 -39.74 61.17 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 123.218 0.607 . . . . 0.0 109.493 173.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.3 -14.51 27.32 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 56.8 p -82.35 -4.31 57.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.671 1.578 . . . . 0.0 112.494 175.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -118.2 84.07 2.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.229 1.412 . . . . 0.0 109.252 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.37 60.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 177.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.29 -29.48 66.24 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.556 1.169 . . . . 0.0 110.048 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.505 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -141.03 158.29 44.14 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.03 1.395 . . . . 0.0 112.781 -178.507 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 130' ' ' LEU . 21.0 m -151.41 171.98 16.66 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 125.336 1.454 . . . . 0.0 108.495 174.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.64 99.33 0.18 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 108.528 -1.829 . . . . 0.0 108.528 172.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.7 p -100.61 136.24 33.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 O-C-N 121.263 -1.139 . . . . 0.0 108.987 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -107.8 76.65 1.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 79.0 mmm -71.74 50.92 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.707 -1.245 . . . . 0.0 111.824 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.5 tpp85 -134.99 129.12 33.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.19 130.03 94.26 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 117.647 -1.168 . . . . 0.0 109.849 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.89 119.45 6.16 Favored 'Cis proline' 0 CA--C 1.54 0.81 0 CA-C-N 119.7 0.928 . . . . 0.0 112.824 3.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -84.76 131.78 34.52 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.92 1.288 . . . . 0.0 109.691 -168.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -141.85 167.96 20.89 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 125.803 1.641 . . . . 0.0 108.95 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 7.5 tmm? -122.75 134.99 54.43 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -119.1 144.44 46.6 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 162.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 118' ' ' THR 0.305 0.1 OUTLIER -112.64 167.71 10.25 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.03 0.932 . . . . 0.0 109.072 160.491 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.505 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 59.4 t -124.0 147.87 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 157.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.11 161.03 15.27 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 172.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.21 -25.05 30.54 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.334 0.97 . . . . 0.0 111.526 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -82.43 -19.35 39.18 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 125.263 1.425 . . . . 0.0 112.009 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 113.94 -9.51 23.21 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.591 1.567 . . . . 0.0 114.484 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 148.19 23.97 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.64 1.72 . . . . 0.0 109.421 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.06 99.02 3.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.978 0.911 . . . . 0.0 108.682 -168.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.4 mp -86.75 142.7 27.95 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 119.733 -1.855 . . . . 0.0 108.504 177.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 90.1 m -109.22 125.22 52.01 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.755 1.622 . . . . 0.0 107.822 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -119.17 151.34 38.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 124.048 0.939 . . . . 0.0 110.453 176.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -99.32 147.83 24.79 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.937 1.695 . . . . 0.0 108.824 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -76.06 111.49 11.51 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 6.5 t -111.43 93.95 4.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 168.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 9.4 t -117.4 26.37 9.79 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.012 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.297 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.234 0.279 0 CA-C-O 122.389 1.09 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -70.99 143.68 89.22 Favored Pre-proline 0 N--CA 1.454 -0.256 0 CA-C-O 117.681 -1.152 . . . . 0.0 108.883 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' A' ' 19' ' ' ALA . 66.5 Cg_endo -78.69 -16.75 12.89 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.959 2.439 . . . . 0.0 112.073 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.91 39.93 0.14 Allowed 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 122.751 1.262 . . . . 0.0 111.602 174.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.406 ' H ' ' C ' ' A' ' 17' ' ' PRO . . . -139.43 -46.22 0.46 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 130.065 3.346 . . . . 0.0 106.4 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.83 -20.69 62.16 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.593 1.157 . . . . 0.0 112.843 -176.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.3 -12.0 54.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 114.773 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 7.18 46.61 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.565 1.546 . . . . 0.0 110.589 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.15 56.32 3.14 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.381 -1.449 . . . . 0.0 109.312 -176.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -135.57 -40.22 0.71 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.623 -0.703 . . . . 0.0 112.296 -161.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.1 39.43 3.67 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 172.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 p -120.92 157.74 29.2 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.506 -1.371 . . . . 0.0 110.975 -174.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -127.6 152.47 47.6 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 123.99 0.916 . . . . 0.0 109.106 -178.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -149.59 162.5 40.07 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 113.257 -1.792 . . . . 0.0 108.604 -166.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.7 t -147.58 136.04 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.2 tp -82.25 150.65 27.19 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 119.276 0.944 . . . . 0.0 110.311 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 t -134.31 -27.32 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -151.79 157.97 42.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.309 1.413 . . . . 0.0 110.389 177.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.436 ' CD1' HD22 ' A' ' 138' ' ' LEU . 1.2 t90 -143.35 106.6 4.55 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.082 2.153 . . . . 0.0 108.469 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.07 131.61 34.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 172.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -61.53 161.61 9.38 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 159.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -44.32 -42.95 7.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.158 1.783 . . . . 0.0 112.654 165.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.23 -14.23 62.17 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.683 1.593 . . . . 0.0 111.987 -173.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.55 1.72 58.93 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.948 1.737 . . . . 0.0 112.64 -175.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.1 m -69.4 108.89 3.92 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.073 1.749 . . . . 0.0 109.794 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.39 140.36 48.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.153 -0.967 . . . . 0.0 110.64 170.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -97.05 166.47 11.58 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.436 1.494 . . . . 0.0 111.606 -175.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.5 102.99 13.96 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 173.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 28.0 m -114.43 148.89 41.21 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 173.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.7 102.69 1.64 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.137 2.558 . . . . 0.0 110.203 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.08 169.31 0.4 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 126.162 1.785 . . . . 0.0 114.442 168.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.87 -37.38 71.26 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.046 0.938 . . . . 0.0 112.873 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -80.86 -15.2 57.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -73.85 -22.92 59.59 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 121.589 -0.694 . . . . 0.0 111.515 -172.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.56 -32.14 2.34 Favored Glycine 0 C--N 1.337 0.604 0 N-CA-C 115.335 0.894 . . . . 0.0 115.335 156.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.17 85.26 8.2 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 172.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 162.28 39.82 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.035 1.823 . . . . 0.0 111.22 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.7 mt -77.99 106.85 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 124.537 1.135 . . . . 0.0 109.093 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -99.41 159.02 15.32 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.377 0.671 . . . . 0.0 109.629 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -140.16 141.97 36.0 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.402 2.281 . . . . 0.0 106.465 165.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.2 m -134.37 145.84 49.35 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 120.833 -1.167 . . . . 0.0 108.146 159.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.4 mt -118.4 117.32 28.74 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 103.71 -2.7 . . . . 0.0 103.71 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -163.54 178.7 7.79 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 171.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.0 p -116.92 16.46 15.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -161.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -51.72 -32.68 31.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.1 p -65.97 -21.82 66.44 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 121.336 1.88 . . . . 0.0 111.875 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.92 -0.03 60.47 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.897 1.713 . . . . 0.0 111.01 -160.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -131.27 167.8 18.6 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.106 1.453 . . . . 0.0 109.771 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -71.51 80.38 0.79 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.732 2.013 . . . . 0.0 106.742 173.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -106.07 112.79 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.518 1.527 . . . . 0.0 109.083 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.54 149.88 45.32 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 168.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -145.65 152.42 39.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 167.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 176.71 -168.74 40.9 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -131.55 128.73 39.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 103.34 -2.837 . . . . 0.0 103.34 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.4 m -119.59 11.19 11.97 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.443 1.02 . . . . 0.0 113.594 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 169.25 -63.09 0.18 Allowed Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.295 -1.281 . . . . 0.0 112.122 168.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 9.2 t -166.96 9.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.632 1.716 . . . . 0.0 113.713 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -112.06 -7.66 14.08 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 118.813 -2.429 . . . . 0.0 112.92 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER 44.21 179.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 127.615 2.366 . . . . 0.0 113.07 -164.246 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 10.2 p90 -160.25 166.77 28.94 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.645 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -157.37 168.3 27.77 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.957 2.503 . . . . 0.0 106.392 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 143.9 175.88 17.42 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.431 1.015 . . . . 0.0 110.876 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.4 m -79.54 164.43 23.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -166.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -142.55 176.84 8.72 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.642 1.177 . . . . 0.0 111.541 170.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -158.3 159.23 35.71 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.147 1.379 . . . . 0.0 110.283 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.87 128.62 50.6 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 125.385 1.474 . . . . 0.0 108.817 -177.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt 176.18 171.58 0.4 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 128.111 2.564 . . . . 0.0 107.175 -171.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t0 58.3 24.13 11.21 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 158.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.01 5.78 59.0 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 118.251 -1.305 . . . . 0.0 113.998 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -131.31 168.41 17.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.806 1.803 . . . . 0.0 112.122 -171.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.5 tp -101.89 109.65 21.44 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 163.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -90.7 159.48 16.34 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -120.1 178.88 4.46 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.497 1.119 . . . . 0.0 110.126 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -101.87 -112.11 3.55 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 175.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 t -143.86 67.16 1.28 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 128.242 2.617 . . . . 0.0 105.284 -162.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.563 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -68.26 163.74 22.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.159 0.984 . . . . 0.0 111.031 -171.618 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.89 172.83 45.81 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 166.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.34 -134.46 2.8 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.2 p -103.22 -167.96 1.45 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.75 1.62 . . . . 0.0 109.774 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -128.24 67.47 1.36 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.045 1.738 . . . . 0.0 109.481 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.7 mtm -101.14 157.26 16.9 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.603 -0.685 . . . . 0.0 109.165 -176.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.27 118.72 32.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.038 0.935 . . . . 0.0 108.643 -171.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -102.37 -22.87 14.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 177.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.256 23.2 ptp 49.49 31.36 3.98 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -169.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 61.1 p -122.64 160.71 47.47 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.502 1.521 . . . . 0.0 107.47 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.8 -41.67 7.7 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.727 1.618 . . . . 0.0 111.632 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.93 -30.96 76.8 Favored Glycine 0 C--N 1.34 0.762 0 CA-C-O 118.699 -1.056 . . . . 0.0 111.005 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -68.98 -17.04 71.26 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.899 1.85 . . . . 0.0 113.242 173.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -98.91 -12.12 21.02 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.577 1.189 . . . . 0.0 112.385 -173.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.7 tt -81.95 -16.13 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -174.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -58.22 -37.65 75.26 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.911 0.778 . . . . 0.0 110.545 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.53 73.71 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-O 118.628 -1.095 . . . . 0.0 113.464 176.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.7 59.75 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 120.097 1.949 . . . . 0.0 110.158 173.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -71.52 -44.22 65.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.5 1.12 . . . . 0.0 110.668 -174.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.81 -28.17 68.59 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.566 -1.334 . . . . 0.0 111.272 172.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.56 -20.57 50.3 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 174.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.2 -37.61 25.8 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.457 1.503 . . . . 0.0 109.927 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -13.77 0.55 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.676 2.391 . . . . 0.0 114.584 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.3 p -114.96 -0.32 13.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.697 1.599 . . . . 0.0 113.09 -176.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -110.51 35.38 3.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.629 1.104 . . . . 0.0 109.973 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.3 mm -71.65 74.4 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.839 1.256 . . . . 0.0 108.017 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.87 -25.77 27.79 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.392 -0.817 . . . . 0.0 109.987 173.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -137.37 164.97 27.33 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 122.445 1.117 . . . . 0.0 112.609 174.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.4 m -158.6 162.91 37.36 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 127.577 2.351 . . . . 0.0 107.126 -176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.02 91.81 0.1 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 108.791 -1.724 . . . . 0.0 108.791 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.2 p -77.53 145.75 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 120.229 -1.748 . . . . 0.0 109.242 166.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -120.31 98.54 6.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.453 1.901 . . . . 0.0 107.401 174.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 12.2 mtp -88.42 1.79 54.01 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 177.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -61.81 132.08 51.96 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 157.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 140.73 98.16 Favored Pre-proline 0 N--CA 1.442 -0.852 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 170.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.42 118.68 4.71 Favored 'Cis proline' 0 N--CA 1.454 -0.8 0 CA-C-N 119.861 0.986 . . . . 0.0 110.558 -1.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -68.46 127.32 32.57 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.742 0.782 . . . . 0.0 109.213 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -140.41 161.49 37.57 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.286 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 40.2 ttp -115.39 148.87 38.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -130.21 133.61 46.68 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 176.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 52.7 mt -119.11 154.01 33.9 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.9 t -142.26 126.63 16.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.7 mt -84.45 170.91 13.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.452 . . . . 0.0 111.224 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -63.05 -2.17 1.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.56 1.944 . . . . 0.0 114.543 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -109.39 -10.29 14.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.89 1.676 . . . . 0.0 112.163 172.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.79 18.57 15.34 Favored Glycine 0 C--N 1.334 0.445 0 O-C-N 120.896 -1.128 . . . . 0.0 114.249 169.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.97 167.87 3.56 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.311 1.044 . . . . 0.0 110.982 174.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -139.66 104.15 4.85 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.348 -0.845 . . . . 0.0 109.059 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.436 HD22 ' CD1' ' A' ' 33' ' ' TRP . 0.6 OUTLIER -92.57 160.74 14.89 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.907 -1.12 . . . . 0.0 110.973 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.6 m -134.85 110.7 9.34 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 122.572 0.349 . . . . 0.0 111.201 -174.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -114.06 140.98 48.02 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 123.972 0.795 . . . . 0.0 110.387 173.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -85.97 147.27 26.3 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 163.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -64.51 137.07 57.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 160.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 36.5 t -123.91 104.58 9.01 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 120.197 1.362 . . . . 0.0 107.99 163.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.3 t -123.12 17.59 9.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 123.489 0.493 . . . . 0.0 111.316 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? . . . . . 0 C--O 1.251 1.172 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 154.499 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.704 -0.11 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -159.25 144.13 11.51 Favored Pre-proline 0 N--CA 1.468 0.47 0 O-C-N 121.301 -0.875 . . . . 0.0 111.583 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.79 -18.98 18.86 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.317 2.012 . . . . 0.0 111.942 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -13.32 23.62 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 119.23 0.923 . . . . 0.0 112.388 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.68 -25.64 49.68 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 119.726 1.148 . . . . 0.0 112.702 172.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -63.33 -31.02 72.07 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.822 0.849 . . . . 0.0 112.389 -160.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -21.8 66.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.753 0.706 . . . . 0.0 112.23 -175.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.0 mt -83.84 -9.43 58.77 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.449 1.1 . . . . 0.0 111.465 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.95 -13.52 62.49 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.813 0.845 . . . . 0.0 112.098 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -60.46 -9.82 4.15 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.801 2.04 . . . . 0.0 112.87 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -128.58 10.0 6.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.595 1.958 . . . . 0.0 111.483 -165.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.8 p -113.69 -174.76 2.53 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.463 -162.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -153.01 -66.58 0.16 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 118.211 -0.9 . . . . 0.0 112.186 -171.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.4 m95 65.88 171.29 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.91 1.284 . . . . 0.0 113.769 176.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.7 t -139.12 135.84 42.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 172.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.2 tp -74.44 143.24 44.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.83 -21.34 0.72 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 175.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -142.49 166.89 23.44 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 120.632 1.56 . . . . 0.0 111.388 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' ' CE1' ' A' ' 108' ' ' TYR . 5.9 t90 -150.65 101.48 2.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.06 2.144 . . . . 0.0 107.492 -176.02 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.6 145.11 25.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 170.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -88.44 172.31 9.46 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.386 0.674 . . . . 0.0 109.542 162.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.91 -34.48 73.25 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.273 1.029 . . . . 0.0 112.836 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.55 5.41 20.93 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.047 0.451 . . . . 0.0 110.823 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.61 11.66 60.41 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.221 1.391 . . . . 0.0 111.439 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 m -74.19 99.32 3.37 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 120.85 -1.383 . . . . 0.0 108.398 -174.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.5 104.36 1.24 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.158 0.98 . . . . 0.0 108.878 168.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 -59.4 157.5 11.01 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.78 1.232 . . . . 0.0 110.118 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.74 124.36 27.15 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.17 150.19 75.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.78 104.44 1.91 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.951 2.434 . . . . 0.0 110.179 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 169.26 11.24 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.006 1.322 . . . . 0.0 108.565 173.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.93 -46.43 71.53 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.786 -0.571 . . . . 0.0 111.618 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.34 -10.4 58.91 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -76.33 -12.04 60.0 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.851 0.86 . . . . 0.0 112.152 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.15 -32.97 4.54 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 124.337 0.97 . . . . 0.0 112.723 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.14 85.85 13.53 Favored Pre-proline 0 N--CA 1.449 -0.486 0 C-N-CA 125.993 1.717 . . . . 0.0 109.268 -171.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.3 132.8 32.69 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.76 1.64 . . . . 0.0 108.676 168.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.3 mt -69.99 98.95 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 O-C-N 121.913 -0.492 . . . . 0.0 109.821 173.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.9 p -75.9 154.0 36.32 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 171.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.67 155.04 39.85 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 172.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 17.6 m -141.9 137.4 31.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 87.1 mt -128.99 60.4 1.55 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.272 1.429 . . . . 0.0 107.947 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.8 t -134.78 172.32 13.13 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.629 1.172 . . . . 0.0 108.238 -171.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -95.52 44.2 1.09 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.282 -1.511 . . . . 0.0 111.408 -160.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -13.38 6.04 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 p -121.18 0.03 10.04 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.158 2.183 . . . . 0.0 112.411 170.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.17 -39.79 2.66 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 127.991 2.71 . . . . 0.0 111.897 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -82.97 172.88 12.31 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.05 0.94 . . . . 0.0 108.691 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -75.87 76.47 2.79 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.956 0.884 . . . . 0.0 110.484 171.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -102.98 123.82 47.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.946 1.698 . . . . 0.0 106.992 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.96 144.49 31.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.872 1.669 . . . . 0.0 107.138 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.25 173.54 11.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 164.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.03 -168.72 38.57 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -135.02 95.19 3.26 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.0 m -73.66 77.37 1.52 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.054 1.341 . . . . 0.0 110.868 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.07 -63.57 1.65 Allowed Glycine 0 C--N 1.333 0.373 0 C-N-CA 125.003 1.287 . . . . 0.0 113.857 158.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.7 m -114.22 -16.95 11.97 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 119.509 1.655 . . . . 0.0 111.219 170.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.71 124.56 18.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 -157.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -73.9 162.66 28.85 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.822 1.296 . . . . 0.0 111.41 163.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -145.7 146.8 31.41 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 130.8 3.64 . . . . 0.0 107.049 -175.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 35.0 mtm -147.29 152.24 37.95 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.5 2.32 . . . . 0.0 106.404 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.23 175.22 34.86 Favored Glycine 0 C--N 1.32 -0.356 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.6 m -78.92 155.03 29.19 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.817 0.808 . . . . 0.0 111.168 -175.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 49.1 p90 -125.69 177.14 6.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.714 1.205 . . . . 0.0 110.558 167.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.4 153.49 34.81 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.099 1.76 . . . . 0.0 109.484 174.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.49 101.3 9.74 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 126.884 2.073 . . . . 0.0 105.666 178.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -154.8 158.88 40.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.487 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.0 t0 44.59 33.42 0.92 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.138 1.375 . . . . 0.0 114.692 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.39 5.14 20.56 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 118.171 -1.349 . . . . 0.0 114.808 -175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -123.51 145.64 48.7 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 120.099 1.95 . . . . 0.0 110.986 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.82 119.9 16.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 169.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -123.98 152.44 42.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 119.037 0.835 . . . . 0.0 109.536 177.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -119.59 175.15 5.99 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.16 -112.48 3.71 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 125.322 1.439 . . . . 0.0 110.458 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -132.08 70.9 1.46 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 127.996 2.519 . . . . 0.0 105.44 -163.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.571 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -71.57 151.77 43.52 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.26 -172.286 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.14 162.99 21.3 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 107.315 -2.314 . . . . 0.0 107.315 172.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.17 -27.19 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.42 0 C-N-CA 119.602 -1.285 . . . . 0.0 113.698 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.5 p -163.85 170.01 17.42 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.346 2.658 . . . . 0.0 109.272 -167.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -128.85 29.35 5.24 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.793 1.637 . . . . 0.0 110.334 -175.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.6 mtt -60.38 141.28 56.52 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 111.137 -168.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -105.57 124.68 49.95 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.227 1.411 . . . . 0.0 108.49 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 59.2 m -127.01 167.85 15.35 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.001 0.92 . . . . 0.0 109.893 168.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 mtp -120.56 47.01 1.87 Allowed 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 -177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.9 p -132.83 156.98 79.48 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.97 1.708 . . . . 0.0 108.128 177.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -60.24 -47.95 13.24 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.967 2.444 . . . . 0.0 110.819 174.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.24 -11.37 58.93 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.922 -0.932 . . . . 0.0 112.115 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.85 -60.22 2.48 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 119.148 1.474 . . . . 0.0 111.521 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -75.95 -18.07 59.48 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.528 1.164 . . . . 0.0 113.939 -168.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.6 tt -60.97 -21.03 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.155 0.982 . . . . 0.0 112.467 176.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -45.77 -46.11 15.06 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.149 1.78 . . . . 0.0 110.52 174.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -66.08 -34.96 89.83 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.77 -1.206 . . . . 0.0 113.042 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.15 75.46 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.691 1.746 . . . . 0.0 110.358 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . 0.476 ' CE1' ' CZ3' ' A' ' 33' ' ' TRP . 10.1 m-85 -60.31 -62.09 2.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.079 1.352 . . . . 0.0 109.782 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.86 -23.29 63.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.426 -173.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -61.78 -59.21 5.5 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 123.012 0.525 . . . . 0.0 110.199 168.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.56 -29.82 70.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.907 1.283 . . . . 0.0 110.902 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tp -56.59 -21.21 25.23 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.935 1.294 . . . . 0.0 112.992 -175.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -85.96 -23.19 27.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.423 1.465 . . . . 0.0 112.223 177.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -94.42 37.95 1.11 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.475 1.51 . . . . 0.0 111.338 -166.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.7 mm -75.96 79.92 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 174.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -79.69 -30.31 41.06 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.433 -0.792 . . . . 0.0 109.982 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -132.98 173.62 11.21 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 127.549 2.34 . . . . 0.0 109.434 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.8 t -159.23 -179.49 8.03 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -172.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.48 84.57 0.08 OUTLIER Glycine 0 CA--C 1.53 0.978 0 C-N-CA 123.691 0.663 . . . . 0.0 112.046 171.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . 0.293 1.7 p -88.88 120.96 38.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 119.101 1.45 . . . . 0.0 109.863 171.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -90.09 96.52 10.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 175.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 43.6 tpp -87.71 60.29 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.582 1.182 . . . . 0.0 108.181 177.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -153.38 135.95 15.16 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 171.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.31 92.89 Favored Pre-proline 0 N--CA 1.443 -0.822 0 CA-C-N 118.568 0.622 . . . . 0.0 110.212 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.5 119.05 3.65 Favored 'Cis proline' 0 N--CA 1.459 -0.536 0 CA-C-N 119.336 0.799 . . . . 0.0 110.262 -8.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -72.5 127.31 32.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 122.208 1.004 . . . . 0.0 108.514 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -142.77 159.68 41.77 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 126.209 1.804 . . . . 0.0 106.527 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.7 ttp -142.17 104.61 4.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -165.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -69.78 144.49 52.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 161.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.75 152.12 33.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 149.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 64.6 t -135.38 120.2 27.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -176.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.46 165.75 21.9 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.055 1.407 . . . . 0.0 111.079 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -53.94 -36.94 63.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.98 2.112 . . . . 0.0 111.273 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -81.82 -11.4 58.98 Favored 'General case' 0 C--O 1.226 -0.166 0 O-C-N 120.915 -1.116 . . . . 0.0 110.431 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.05 12.11 30.43 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 123.981 0.801 . . . . 0.0 113.902 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.18 166.19 5.08 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.172 1.486 . . . . 0.0 110.57 174.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.1 m -151.09 99.5 2.69 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 120.405 -1.434 . . . . 0.0 109.956 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -78.05 166.45 22.8 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 121.119 -0.988 . . . . 0.0 109.769 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 18.3 m -132.47 120.91 22.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -119.53 156.6 29.98 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.844 0.715 . . . . 0.0 110.09 168.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 131.09 53.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 126.863 2.065 . . . . 0.0 108.514 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.24 110.55 2.62 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.341 1.457 . . . . 0.0 110.427 -176.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.91 73.69 1.51 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 170.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.3 m -88.54 37.45 0.83 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 168.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.156 0 O-C-N 119.97 -1.706 . . . . 0.0 111.042 -172.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.719 0.771 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -142.03 143.31 27.65 Favored Pre-proline 0 N--CA 1.457 -0.106 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.734 -173.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.24 -35.79 2.78 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.493 2.128 . . . . 0.0 111.212 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.48 72.96 1.01 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.523 1.929 . . . . 0.0 108.94 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -173.51 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 129.672 3.189 . . . . 0.0 108.037 174.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.5 m -63.31 -22.99 67.22 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.177 -0.952 . . . . 0.0 111.689 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -56.8 -15.99 5.75 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.499 1.12 . . . . 0.0 113.416 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.0 mt -98.42 5.14 48.35 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.683 1.193 . . . . 0.0 111.853 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.11 75.01 2.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.939 1.696 . . . . 0.0 108.571 178.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -143.96 -29.29 0.5 Allowed 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 168.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -111.24 -5.52 14.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.892 1.277 . . . . 0.0 112.665 173.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.4 p -71.26 176.05 4.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.811 1.244 . . . . 0.0 110.814 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.3 -64.67 0.52 Allowed 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 120.594 -1.316 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 67.77 163.01 0.2 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.974 1.71 . . . . 0.0 112.949 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -140.83 136.41 34.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 48.5 tp -85.26 135.58 33.86 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.92 -12.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 176.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.98 151.51 39.84 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.762 1.619 . . . . 0.0 111.714 172.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -142.17 101.16 3.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.31 1.844 . . . . 0.0 106.813 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.51 140.44 29.53 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.075 -1.016 . . . . 0.0 108.556 170.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -78.67 170.13 17.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.823 0.738 . . . . 0.0 111.542 166.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -21.8 38.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.313 2.245 . . . . 0.0 114.757 -177.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -111.08 1.86 17.59 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.528 1.058 . . . . 0.0 112.049 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 117.36 0.67 18.58 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.054 0.835 . . . . 0.0 113.795 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.2 m -67.62 95.29 0.47 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.156 1.478 . . . . 0.0 110.156 -175.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.35 107.08 1.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 O-C-N 120.16 -1.587 . . . . 0.0 111.091 171.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -65.72 159.9 24.06 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.974 1.709 . . . . 0.0 110.94 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.24 34.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 170.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.9 m -137.52 164.73 39.43 Favored Pre-proline 0 C--O 1.236 0.39 0 C-N-CA 123.824 0.85 . . . . 0.0 109.148 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 112.97 3.6 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 121.947 1.765 . . . . 0.0 110.478 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -64.74 178.09 0.84 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.151 0.981 . . . . 0.0 110.245 162.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.76 99.8 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.396 -0.815 . . . . 0.0 110.241 165.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -32.24 73.8 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.332 1.453 . . . . 0.0 110.91 -174.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -59.5 -12.99 7.28 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.219 1.808 . . . . 0.0 113.479 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -45.16 1.36 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 124.098 0.856 . . . . 0.0 111.563 165.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.88 77.89 75.98 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.447 1.499 . . . . 0.0 109.087 -175.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.22 154.72 69.44 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 124.569 3.513 . . . . 0.0 112.138 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.45 100.07 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.051 0.94 . . . . 0.0 108.472 171.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.3 p -92.14 154.78 18.48 Favored 'General case' 0 C--O 1.241 0.647 0 O-C-N 121.816 -0.552 . . . . 0.0 110.068 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -121.28 155.33 34.91 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.068 1.747 . . . . 0.0 106.882 173.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.9 m -147.78 99.48 3.1 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.568 -0.707 . . . . 0.0 109.667 176.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.89 125.35 29.14 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.06 -164.34 1.59 Allowed 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 p -139.16 24.15 2.54 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.737 2.815 . . . . 0.0 110.679 -169.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.9 p -68.62 0.44 4.15 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -167.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.0 p -117.5 1.5 12.32 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.962 1.705 . . . . 0.0 110.933 171.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.4 -48.35 0.95 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 127.447 2.451 . . . . 0.0 110.564 -176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -93.26 170.68 9.44 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.751 1.62 . . . . 0.0 109.157 -169.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -73.55 101.44 3.57 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -124.23 141.95 51.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.12 100.59 10.06 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 126.364 1.866 . . . . 0.0 106.715 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.2 t -108.35 148.43 30.09 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 164.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.38 -162.13 12.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 106.799 -2.52 . . . . 0.0 106.799 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -108.37 -11.99 15.11 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -171.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.2 m 51.52 -164.96 0.05 Allowed 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 129.886 3.274 . . . . 0.0 111.601 -172.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.49 -30.23 33.39 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.444 1.497 . . . . 0.0 113.247 172.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.0 t -174.91 0.06 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.486 0.715 . . . . 0.0 112.258 162.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.419 ' ND2' ' H ' ' A' ' 95' ' ' MET . 2.6 m120 -125.68 102.74 7.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 123.665 1.698 . . . . 0.0 109.575 -175.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.5 132.44 48.49 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.945 -171.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.07 165.14 12.65 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 128.153 2.581 . . . . 0.0 109.446 -164.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.5 mtm -152.45 156.59 39.77 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.512 -2.033 . . . . 0.0 105.512 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.69 175.83 30.06 Favored Glycine 0 C--N 1.318 -0.44 0 C-N-CA 124.607 1.099 . . . . 0.0 110.397 173.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.4 m -87.48 165.24 15.67 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 122.092 -0.652 . . . . 0.0 110.927 -173.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -145.96 178.33 8.27 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -159.07 155.89 28.21 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.073 1.749 . . . . 0.0 109.569 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mp -112.31 127.08 55.89 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 125.512 1.525 . . . . 0.0 107.754 175.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 169.36 15.01 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 124.795 1.238 . . . . 0.0 109.317 171.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.6 t0 44.66 44.88 7.77 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.739 1.616 . . . . 0.0 113.477 168.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.82 0.66 5.39 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 115.585 0.994 . . . . 0.0 115.585 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -127.33 172.2 10.84 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 126.227 1.811 . . . . 0.0 112.013 -166.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.03 103.31 9.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -174.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -90.86 151.51 21.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -118.08 -179.83 3.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 123.485 0.714 . . . . 0.0 110.698 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -107.61 -105.32 3.0 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 176.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 m -140.91 71.62 1.37 Allowed 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 -169.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.488 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -63.33 167.04 5.64 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.528 0.68 . . . . 0.0 111.033 -177.698 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.79 170.95 26.08 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 107.711 -2.155 . . . . 0.0 107.711 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -155.42 -156.08 7.62 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -160.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.4 p -76.88 -179.69 5.61 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 122.255 -0.556 . . . . 0.0 109.622 165.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -133.68 86.98 2.33 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 163.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' MET . . . . . 0.419 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 10.0 mtt -80.52 154.46 27.51 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 174.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.47 140.39 58.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 159.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 98.9 m -142.71 -19.27 0.67 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.481 1.113 . . . . 0.0 113.392 172.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.0 mtm 62.18 25.57 15.31 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.38 1.072 . . . . 0.0 113.739 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -123.81 161.56 45.81 Favored Pre-proline 0 C--O 1.24 0.562 0 C-N-CA 125.909 1.683 . . . . 0.0 110.233 -176.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.27 -33.0 19.42 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.68 2.253 . . . . 0.0 111.231 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -60.14 -33.75 81.07 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.967 0.794 . . . . 0.0 111.524 172.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.92 -43.19 99.65 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 118.076 0.938 . . . . 0.0 112.42 172.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -85.85 -33.25 21.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.138 0.969 . . . . 0.0 112.895 -170.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 17.6 tt -61.01 -18.29 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 118.819 0.736 . . . . 0.0 111.599 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -56.96 -36.21 70.02 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 121.352 -0.842 . . . . 0.0 111.858 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.86 -26.55 60.7 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.282 -0.732 . . . . 0.0 112.414 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.26 -40.17 15.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 118.697 1.249 . . . . 0.0 110.601 173.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -30.54 57.07 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 -158.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.1 mt -60.41 -38.94 85.6 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.808 1.243 . . . . 0.0 110.068 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -36.95 67.34 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 122.782 0.433 . . . . 0.0 110.361 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.95 66.09 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 122.083 -0.385 . . . . 0.0 111.288 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.88 -7.32 39.25 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.12 -0.943 . . . . 0.0 113.349 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.7 p -94.77 -11.68 28.54 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 120.789 1.631 . . . . 0.0 112.317 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -113.54 35.31 4.08 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.169 0.987 . . . . 0.0 110.782 -172.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 mm -72.15 72.96 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -75.92 -35.15 59.86 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 169.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -127.54 160.71 30.69 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.138 0.975 . . . . 0.0 110.731 -173.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -151.35 158.11 43.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.604 1.162 . . . . 0.0 107.961 169.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.51 108.37 0.44 Allowed Glycine 0 N--CA 1.441 -1.018 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 172.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.5 156.19 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 118.936 1.368 . . . . 0.0 111.174 169.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -136.92 112.07 9.06 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 39.5 ttm -108.45 66.99 0.65 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.514 1.526 . . . . 0.0 109.385 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -152.69 80.6 1.22 Allowed 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.789 1.236 . . . . 0.0 109.458 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -27.88 119.94 0.26 Allowed Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 127.697 2.399 . . . . 0.0 112.437 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.56 122.72 8.81 Favored 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.317 0.792 . . . . 0.0 111.758 15.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -83.28 141.91 31.49 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -172.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -141.53 170.13 16.31 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 161.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -143.22 142.34 31.38 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 127.732 2.413 . . . . 0.0 105.226 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.15 129.08 33.27 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 -174.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 97.1 mt -103.86 140.4 37.72 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.7 t -127.22 123.67 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.94 165.2 25.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -59.66 -33.15 71.18 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.578 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.05 -21.88 39.74 Favored 'General case' 0 C--N 1.341 0.207 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.406 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.15 6.45 12.26 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.37 -1.239 . . . . 0.0 115.407 168.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.68 133.64 55.83 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.587 2.193 . . . . 0.0 108.72 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.4 m -116.33 103.36 10.4 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.845 2.058 . . . . 0.0 108.265 -169.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.8 mp -94.55 114.18 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 51.1 m -86.03 124.31 32.32 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 170.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -99.35 163.4 12.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.484 1.514 . . . . 0.0 108.621 167.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.38 147.64 34.76 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.089 1.756 . . . . 0.0 108.279 163.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.2 tpt85 -81.15 109.41 15.67 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.8 t -91.27 108.52 19.94 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 105.03 -2.211 . . . . 0.0 105.03 163.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.77 16.77 17.33 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.693 2.397 . . . . 0.0 110.69 165.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.188 0 CA-C-O 116.52 -1.705 . . . . 0.0 107.126 164.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 . . . . . 0 C--O 1.237 0.418 0 CA-C-O 121.685 0.755 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -94.25 144.63 28.33 Favored Pre-proline 0 C--O 1.232 0.152 0 CA-C-N 115.378 -0.828 . . . . 0.0 113.128 -166.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.1 -28.47 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.669 2.246 . . . . 0.0 111.689 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.78 -21.14 64.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.77 0.828 . . . . 0.0 112.934 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.96 -16.67 57.98 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.221 -0.925 . . . . 0.0 111.71 176.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.512 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.2 t -72.79 -21.01 61.06 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.842 1.201 . . . . 0.0 110.451 -168.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.76 3.4 9.9 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 120.01 -1.681 . . . . 0.0 110.743 -177.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -121.56 29.2 7.31 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.095 2.158 . . . . 0.0 109.348 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.512 ' CD2' ' HA ' ' A' ' 20' ' ' THR . 3.8 mm? -103.09 74.1 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.905 2.082 . . . . 0.0 105.896 167.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.256 2.0 p30 -129.44 -62.54 0.97 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.353 -172.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 2.12 45.2 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.415 1.486 . . . . 0.0 110.804 171.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.99 162.18 29.84 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.698 1.999 . . . . 0.0 109.57 -171.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.1 m -156.08 144.12 19.75 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 118.589 -2.569 . . . . 0.0 107.701 -173.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TRP . . . . . 0.403 ' HA ' ' H ' ' A' ' 143' ' ' SER . 28.2 m95 -149.02 175.79 11.0 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 124.171 0.92 . . . . 0.0 112.192 -161.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.65 118.63 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 174.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.41 139.12 57.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.124 -175.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 t -145.63 -2.17 0.76 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 113.274 171.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.43 157.35 42.93 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.036 1.289 . . . . 0.0 110.281 168.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TRP . . . . . 0.429 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -152.56 100.39 2.55 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 127.098 2.159 . . . . 0.0 105.829 172.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.66 142.84 27.93 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -81.99 170.94 14.99 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 164.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.26 72.36 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 123.574 0.546 . . . . 0.0 111.502 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -86.08 3.13 43.87 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.802 1.641 . . . . 0.0 112.054 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.93 1.14 57.29 Favored Glycine 0 CA--C 1.524 0.605 0 O-C-N 120.746 -1.222 . . . . 0.0 112.789 167.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.4 m -67.01 95.74 0.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 126.344 1.857 . . . . 0.0 109.407 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.77 112.4 2.01 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.958 -1.089 . . . . 0.0 109.759 165.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -71.7 149.6 45.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.378 1.071 . . . . 0.0 109.507 176.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.49 105.73 15.53 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 124.364 1.066 . . . . 0.0 109.164 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.9 m -113.51 152.26 45.19 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 125.872 1.669 . . . . 0.0 107.207 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -73.97 120.08 6.18 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 121.887 1.724 . . . . 0.0 109.034 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.24 171.11 13.61 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.216 0.606 . . . . 0.0 110.119 171.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -38.69 77.28 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 121.895 -0.503 . . . . 0.0 110.459 169.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -9.5 58.66 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -81.57 -29.69 33.31 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.864 0.866 . . . . 0.0 111.803 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.51 -80.01 0.24 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -170.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.07 85.23 58.24 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.163 1.385 . . . . 0.0 110.137 -168.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.47 152.44 75.1 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.187 1.925 . . . . 0.0 111.036 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.1 mt -78.03 101.7 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.9 177.78 6.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.225 1.375 . . . . 0.0 108.5 174.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -144.23 146.85 32.92 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 127.031 2.133 . . . . 0.0 106.966 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -145.29 143.52 30.25 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 105.917 -1.882 . . . . 0.0 105.917 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.03 128.96 41.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 172.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -159.8 177.75 10.5 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -129.43 24.03 5.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.121 0.968 . . . . 0.0 112.574 -171.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.79 -31.44 11.67 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.1 p -92.95 8.05 41.42 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.123 177.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.83 -0.46 51.15 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.21 1.386 . . . . 0.0 111.908 -166.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -117.89 161.6 19.49 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 126.037 1.735 . . . . 0.0 108.622 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -75.56 63.47 1.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 124.709 1.203 . . . . 0.0 109.832 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.96 110.64 18.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 120.801 1.637 . . . . 0.0 110.187 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.66 152.5 27.09 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.668 -1.605 . . . . 0.0 107.257 159.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.5 p -141.94 -177.88 5.42 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 125.092 1.357 . . . . 0.0 107.964 161.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.16 168.39 39.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 163.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 5.7 t80 -89.75 138.35 31.56 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 160.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.5 t -118.71 71.44 0.85 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.01 -36.21 0.4 Allowed Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.975 2.226 . . . . 0.0 116.982 167.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 7.6 t -146.49 -14.26 0.44 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.199 1.399 . . . . 0.0 111.893 163.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -130.06 115.52 17.22 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -64.5 162.46 15.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.519 164.363 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -139.09 168.45 19.81 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 125.341 1.457 . . . . 0.0 109.223 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.8 ptp -152.16 172.81 15.79 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.098 2.159 . . . . 0.0 108.185 170.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.3 -143.62 7.52 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.654 -2.178 . . . . 0.0 107.654 168.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.1 m -125.26 161.23 27.4 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 119.281 1.541 . . . . 0.0 112.777 165.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -128.62 173.62 10.13 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.228 1.011 . . . . 0.0 111.847 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -154.22 139.89 17.98 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.373 1.069 . . . . 0.0 110.349 -176.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.26 120.6 42.27 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 168.45 22.74 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.535 1.534 . . . . 0.0 109.226 169.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t0 48.31 39.06 11.55 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.065 1.346 . . . . 0.0 113.713 167.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.3 13.14 48.32 Favored Glycine 0 CA--C 1.535 1.291 0 O-C-N 120.233 -1.542 . . . . 0.0 114.56 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -134.65 164.8 26.7 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 119.244 1.522 . . . . 0.0 113.01 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.0 tp -109.92 96.83 6.5 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.693 1.597 . . . . 0.0 106.812 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.3 m -87.43 162.3 17.36 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.3 155.92 47.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.773 1.629 . . . . 0.0 109.166 -176.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.11 -106.6 0.15 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 170.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -143.83 58.84 1.37 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.232 1.015 . . . . 0.0 108.465 -154.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.534 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -60.45 153.11 23.94 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 121.142 -0.974 . . . . 0.0 112.913 -165.805 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.78 173.1 45.42 Favored Glycine 0 N--CA 1.453 -0.201 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -147.54 -117.29 0.97 Allowed Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.3 p -120.82 178.25 4.78 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.689 1.196 . . . . 0.0 110.928 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.6 mtt85 -113.43 73.51 0.82 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.274 1.03 . . . . 0.0 108.68 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtt -74.58 176.99 6.37 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.038 -1.039 . . . . 0.0 109.342 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.43 147.74 52.39 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.55 1.14 . . . . 0.0 109.679 173.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 9.9 m -136.41 -12.62 1.83 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.17 1.788 . . . . 0.0 114.211 177.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 66.03 22.11 11.22 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.856 1.663 . . . . 0.0 113.36 176.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.2 p -110.41 165.3 12.93 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 124.009 0.924 . . . . 0.0 111.191 -165.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.92 -11.46 25.6 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.533 2.155 . . . . 0.0 112.768 164.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -93.05 -9.82 60.37 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-N 118.983 0.811 . . . . 0.0 112.881 168.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.11 -53.44 9.21 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 119.19 1.495 . . . . 0.0 112.487 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -88.2 -16.18 34.0 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -167.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.99 -17.98 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.296 170.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -44.75 -55.18 5.53 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.002 1.321 . . . . 0.0 110.06 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.63 -6.14 70.6 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.002 -0.888 . . . . 0.0 113.742 -173.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -87.08 -51.79 5.8 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.835 1.817 . . . . 0.0 109.005 162.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.84 -47.62 76.91 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.799 1.24 . . . . 0.0 111.416 -171.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.98 -44.39 91.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.059 0.391 . . . . 0.0 110.388 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.44 -34.09 76.1 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.548 0.739 . . . . 0.0 111.624 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.14 59.89 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.95 0.9 . . . . 0.0 112.564 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -72.94 -8.21 54.6 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.475 1.034 . . . . 0.0 112.257 172.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 13.7 p -83.75 -5.07 59.11 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.191 -0.943 . . . . 0.0 111.768 175.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -127.33 83.33 2.16 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.064 2.146 . . . . 0.0 107.283 -169.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -122.18 59.41 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.228 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.41 -22.88 62.68 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.895 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -135.09 165.76 24.62 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.767 1.627 . . . . 0.0 111.095 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 11.2 m -159.93 170.17 21.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.757 1.623 . . . . 0.0 109.019 176.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.06 83.42 0.13 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 125.01 1.29 . . . . 0.0 110.037 168.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.4 p -81.3 151.48 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.475 1.637 . . . . 0.0 109.898 168.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -127.0 90.84 3.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.701 1.6 . . . . 0.0 107.603 175.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 35.2 ttm -77.72 73.29 4.29 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.292 1.044 . . . . 0.0 109.25 169.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -151.45 143.42 23.88 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.574 -2.009 . . . . 0.0 105.574 162.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.07 133.44 95.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 119.72 1.145 . . . . 0.0 108.732 173.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -75.49 117.76 4.96 Favored 'Cis proline' 0 N--CA 1.455 -0.781 0 CA-C-N 120.289 1.139 . . . . 0.0 110.923 -2.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -71.21 132.51 45.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -172.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -144.08 163.23 34.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.234 1.014 . . . . 0.0 108.636 173.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.0 ttp -126.44 115.45 19.62 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -86.31 148.7 25.49 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 158.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.47 155.31 45.02 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 126.147 1.779 . . . . 0.0 106.455 167.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.2 t -141.45 125.67 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -174.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.14 165.6 24.67 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.11 -30.77 38.4 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 125.985 1.714 . . . . 0.0 111.843 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.14 -37.77 69.36 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.2 1.0 . . . . 0.0 109.019 -176.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.15 13.56 4.85 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.938 1.256 . . . . 0.0 113.873 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.12 156.36 5.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.174 1.987 . . . . 0.0 110.204 174.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.8 m -126.45 97.62 5.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 33' ' ' TRP . 0.4 OUTLIER -85.0 162.11 19.49 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.257 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 88.2 m -152.94 133.06 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.124 0.57 . . . . 0.0 109.565 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -126.31 156.01 41.08 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.597 1.559 . . . . 0.0 110.689 -176.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.62 156.85 17.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 117.12 -1.419 . . . . 0.0 107.279 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -81.82 91.94 6.59 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 122.613 2.461 . . . . 0.0 109.706 163.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' SER . . . . . 0.403 ' H ' ' HA ' ' A' ' 28' ' ' TRP . 26.6 t -81.72 90.18 6.33 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 166.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 t -91.02 1.83 56.78 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 175.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 129.752 3.221 . . . . 0.0 114.035 -174.261 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 56.5 mt . . . . . 0 N--CA 1.472 0.635 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.86 -170.54 0.47 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.299 2.666 . . . . 0.0 109.912 167.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.5 170.89 11.14 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.619 -0.676 . . . . 0.0 110.204 173.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -53.85 160.79 1.97 Allowed Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.796 152.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -75.93 -14.99 19.01 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.582 2.855 . . . . 0.0 114.052 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.9 178.39 0.23 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.484 2.314 . . . . 0.0 110.669 -164.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 32.4 t -98.35 109.47 22.22 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 127.126 2.171 . . . . 0.0 110.243 -171.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -136.63 45.83 2.27 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.882 0.849 . . . . 0.0 112.327 171.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -150.58 110.01 3.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.119 -0.988 . . . . 0.0 109.091 -178.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.6 t -134.71 97.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 171.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -164.9 156.23 13.1 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 121.425 -0.797 . . . . 0.0 111.539 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.24 161.85 32.45 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 123.72 2.947 . . . . 0.0 111.728 176.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.8 158.61 70.39 Favored Pre-proline 0 C--O 1.242 0.663 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -175.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.84 -173.05 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 124.065 3.177 . . . . 0.0 111.838 -171.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 64.19 -178.25 0.16 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.664 1.586 . . . . 0.0 110.376 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -161.52 143.36 8.76 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 124.591 1.156 . . . . 0.0 108.916 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -80.95 -31.83 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.714 2.943 . . . . 0.0 111.844 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.2 56.8 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.349 1.059 . . . . 0.0 110.707 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 21' ' ' GLN . . . -154.56 -41.18 0.09 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 129.69 3.196 . . . . 0.0 107.024 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.13 21.45 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.018 1.327 . . . . 0.0 113.766 177.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.461 ' H ' ' C ' ' A' ' 19' ' ' ALA . 11.7 pt20 -120.34 1.48 10.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.668 2.787 . . . . 0.0 111.428 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mp -113.2 2.27 15.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 129.199 3.0 . . . . 0.0 109.341 175.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -81.51 67.71 7.57 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.628 1.571 . . . . 0.0 107.891 -178.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.57 -48.52 0.76 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 122.975 0.51 . . . . 0.0 111.032 -173.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.12 65.75 0.92 Allowed 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.4 p -135.67 171.09 14.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.229 1.012 . . . . 0.0 109.592 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 m -156.12 148.91 24.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.335 -2.103 . . . . 0.0 107.557 -178.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -158.67 154.46 26.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -161.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -134.93 129.22 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -76.81 130.28 37.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 106.174 -1.788 . . . . 0.0 106.174 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -123.05 -16.39 7.03 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -156.58 147.29 21.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 119.423 1.01 . . . . 0.0 108.917 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -135.67 115.2 12.71 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.32 145.69 27.83 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.088 0.955 . . . . 0.0 109.453 174.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -79.45 167.07 21.31 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.918 0.487 . . . . 0.0 110.333 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.69 70.43 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.632 0.773 . . . . 0.0 112.909 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -85.39 -30.25 23.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.23 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 139.59 -0.74 2.25 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-O 118.434 -1.203 . . . . 0.0 115.065 176.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.5 m -64.79 108.64 1.8 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 120.822 2.311 . . . . 0.0 109.758 176.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.53 110.13 1.38 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.037 0.535 . . . . 0.0 109.737 165.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 42.7 mtt-85 -63.72 171.69 2.56 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.15 1.38 . . . . 0.0 110.106 173.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.84 127.08 43.55 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 m -129.8 155.23 80.79 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.605 0.762 . . . . 0.0 109.566 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.35 103.48 1.69 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.62 2.213 . . . . 0.0 110.257 178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.2 m -61.1 158.25 14.14 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 166.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.7 -17.13 62.67 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.172 0.989 . . . . 0.0 113.467 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -72.39 -12.07 60.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.641 0.655 . . . . 0.0 112.662 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.0 -22.04 18.8 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 -165.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.39 -9.42 8.28 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 164.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.78 76.21 3.83 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.418 1.887 . . . . 0.0 110.031 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.93 160.97 46.11 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 123.897 3.065 . . . . 0.0 111.678 -178.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -89.23 107.01 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 124.077 0.951 . . . . 0.0 109.313 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.1 p -112.39 154.33 25.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.914 1.286 . . . . 0.0 109.596 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.22 143.07 50.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 127.724 2.41 . . . . 0.0 106.627 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.2 m -137.3 128.57 27.97 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 68.0 mt -120.09 118.56 30.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 104.858 -2.275 . . . . 0.0 104.858 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -168.71 168.36 10.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -75.29 48.66 0.43 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.051 0.94 . . . . 0.0 110.636 168.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -69.93 -20.66 63.34 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 112.402 -171.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.2 p -98.21 -0.02 44.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.54 1.136 . . . . 0.0 111.459 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.44 -17.16 57.09 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.972 1.748 . . . . 0.0 111.955 -161.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -122.51 170.19 10.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.901 1.85 . . . . 0.0 110.87 -175.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -71.53 81.46 0.81 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 123.725 0.81 . . . . 0.0 109.913 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -126.32 113.4 16.88 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.86 1.264 . . . . 0.0 107.69 -170.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.64 148.63 51.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.534 169.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 p -147.19 165.67 29.31 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 125.084 1.354 . . . . 0.0 107.744 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 165.53 -174.75 41.32 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -122.66 113.98 19.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.3 m -125.57 94.41 4.13 Favored 'General case' 0 CA--C 1.516 -0.36 0 O-C-N 123.685 0.616 . . . . 0.0 110.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.0 -101.93 1.4 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 108.077 -2.009 . . . . 0.0 108.077 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -138.07 25.98 2.72 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.819 1.31 . . . . 0.0 111.187 164.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -140.79 128.48 21.57 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 -170.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -73.42 147.83 43.86 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.803 -0.561 . . . . 0.0 110.304 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -123.72 169.32 11.63 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 125.143 1.377 . . . . 0.0 110.373 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -161.17 169.13 22.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.953 1.701 . . . . 0.0 109.189 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.21 173.62 25.0 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.642 1.591 . . . . 0.0 110.127 166.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.5 p -79.46 165.45 23.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.275 1.038 . . . . 0.0 111.021 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.3 p90 -140.34 174.54 10.41 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.154 0.582 . . . . 0.0 111.449 172.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.73 150.82 26.61 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.612 1.565 . . . . 0.0 109.072 174.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.67 128.55 55.33 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 123.887 0.875 . . . . 0.0 108.829 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.7 ptpt -164.14 162.22 22.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.35 1.86 . . . . 0.0 109.002 173.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.409 ' HB2' ' HZ2' ' A' ' 84' ' ' LYS . 2.1 m-20 52.2 22.55 1.99 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.579 2.352 . . . . 0.0 114.749 174.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.62 12.79 84.11 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-O 118.388 -1.229 . . . . 0.0 112.973 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.409 ' HZ2' ' HB2' ' A' ' 82' ' ' ASP . 14.8 pttm -124.98 171.01 10.56 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.588 1.555 . . . . 0.0 112.47 179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 50.7 tp -109.94 100.14 9.14 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.832 1.653 . . . . 0.0 107.237 175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 m -79.22 155.98 28.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -120.36 159.13 25.67 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.44 0.696 . . . . 0.0 109.802 173.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.9 -155.95 30.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.7 m -63.17 95.6 0.09 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.523 1.129 . . . . 0.0 108.965 166.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 19.5 mt -79.41 175.46 10.58 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 126.281 1.832 . . . . 0.0 110.571 168.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.88 177.33 33.9 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 168.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.25 -132.18 1.97 Allowed Glycine 0 CA--C 1.522 0.508 0 CA-C-O 118.234 -1.314 . . . . 0.0 110.291 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.3 p -143.78 156.2 44.42 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.147 1.779 . . . . 0.0 111.032 -173.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -103.55 61.29 0.76 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 122.146 0.974 . . . . 0.0 108.526 -163.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 18.7 mtm -71.03 172.12 9.66 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 167.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -131.73 124.81 30.52 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.544 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 6.3 m -118.16 8.39 12.35 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 117.317 -1.325 . . . . 0.0 113.067 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 25.4 ptp 44.67 41.14 4.66 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.208 1.803 . . . . 0.0 113.869 173.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.01 156.15 65.26 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.09 0.956 . . . . 0.0 109.838 -167.121 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.24 -36.92 6.47 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.211 2.608 . . . . 0.0 110.924 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.26 -3.97 89.82 Favored Glycine 0 C--O 1.219 -0.834 0 CA-C-O 117.436 -1.758 . . . . 0.0 111.289 174.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.47 -61.06 1.74 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-N 120.897 2.349 . . . . 0.0 111.888 170.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.99 -18.4 63.24 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -172.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -61.26 -8.01 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.976 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -44.42 -48.73 9.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 119.276 0.944 . . . . 0.0 111.073 162.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.94 -52.38 52.61 Favored Glycine 0 C--N 1.337 0.595 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.82 -43.95 97.83 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.517 0.727 . . . . 0.0 110.631 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -62.17 -48.43 80.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.29 1.036 . . . . 0.0 109.944 -173.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.0 mt -59.83 -37.21 78.57 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.312 0.505 . . . . 0.0 110.741 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -16.75 64.38 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.34 -7.17 32.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.064 1.345 . . . . 0.0 111.618 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 91.0 mt -83.67 -13.39 54.25 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.181 1.355 . . . . 0.0 111.66 173.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -5.06 59.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.43 1.092 . . . . 0.0 113.445 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -134.33 78.58 1.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.421 1.089 . . . . 0.0 108.408 -171.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 27.5 mm -103.71 35.6 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.081 1.352 . . . . 0.0 110.337 -172.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -23.35 67.18 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.527 -1.983 . . . . 0.0 113.605 -164.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -124.5 158.3 33.23 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.156 1.382 . . . . 0.0 109.025 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 51.6 m -155.56 124.83 6.25 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.051 -1.031 . . . . 0.0 110.943 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -101.61 131.15 10.48 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 127.311 2.386 . . . . 0.0 110.383 171.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -137.48 138.29 44.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 O-C-N 120.223 -1.751 . . . . 0.0 107.974 159.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.85 97.25 5.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 169.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 29.7 mtp -76.73 -5.51 48.37 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 127.06 30.29 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.578 1.551 . . . . 0.0 108.599 158.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.0 137.97 53.39 Favored Pre-proline 0 N--CA 1.445 -0.72 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -83.45 110.21 1.77 Allowed 'Cis proline' 0 CA--C 1.536 0.615 0 CA-C-N 120.615 1.255 . . . . 0.0 111.675 9.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -68.66 129.67 40.62 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.93 1.292 . . . . 0.0 111.374 -164.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -141.26 112.1 7.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.549 0.69 . . . . 0.0 109.449 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 56.4 ttp -75.96 157.09 33.54 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.1 112.0 5.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 121.381 -0.824 . . . . 0.0 109.596 177.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 79.2 mt -86.72 156.78 19.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.1 t -142.72 137.81 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.49 167.35 10.67 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -62.08 -19.92 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.008 1.323 . . . . 0.0 113.327 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.33 -32.55 60.96 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.003 0.82 . . . . 0.0 109.865 172.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.63 0.51 20.04 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 117.84 -1.534 . . . . 0.0 113.425 -165.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.37 159.07 13.18 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.025 1.913 . . . . 0.0 108.784 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 m -138.45 141.07 39.5 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.666 1.121 . . . . 0.0 109.088 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -132.78 111.39 11.07 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 120.423 -1.423 . . . . 0.0 108.179 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.3 m -88.47 118.65 28.26 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 124.94 1.296 . . . . 0.0 110.238 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -110.25 139.77 45.09 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.891 0.876 . . . . 0.0 110.742 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.99 153.99 33.97 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 160.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -69.75 147.49 50.41 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 158.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 1.6 t -138.81 101.39 4.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 p -81.31 -5.27 57.64 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 . . . . . 0 C--O 1.254 1.301 0 CA-C-O 117.105 -1.426 . . . . 0.0 111.144 -142.178 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.465 0.296 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -69.67 158.49 56.89 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.547 2.165 . . . . 0.0 110.374 168.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt 174.57 167.52 0.25 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 130.735 3.614 . . . . 0.0 105.789 167.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.1 m80 63.3 166.62 0.11 Allowed Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 123.972 0.909 . . . . 0.0 112.099 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -67.89 78.53 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.087 1.858 . . . . 0.0 108.304 166.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.15 -174.47 4.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.003 1.721 . . . . 0.0 107.877 -167.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.0 p -79.85 -166.77 1.07 Allowed 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.993 -1.067 . . . . 0.0 113.159 -173.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 65.99 29.68 10.04 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.211 1.804 . . . . 0.0 113.758 -177.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -124.11 39.7 3.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.132 0.973 . . . . 0.0 112.622 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.62 129.82 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 56.61 165.91 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.893 1.677 . . . . 0.0 114.472 -171.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -64.81 149.03 90.24 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 N-CA-C 108.771 -1.28 . . . . 0.0 108.771 153.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.56 165.16 51.73 Favored Pre-proline 0 C--O 1.24 0.604 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -68.87 -165.57 0.14 Allowed 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.719 2.946 . . . . 0.0 111.007 173.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 55.58 71.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.931 1.292 . . . . 0.0 112.663 162.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -125.13 144.04 46.09 Favored Pre-proline 0 N--CA 1.474 0.772 0 O-C-N 121.405 -0.809 . . . . 0.0 112.621 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.06 -23.17 18.6 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.711 2.941 . . . . 0.0 111.977 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.45 -25.72 2.8 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.198 1.399 . . . . 0.0 113.729 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.72 -2.38 57.01 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.065 -1.022 . . . . 0.0 113.311 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 m -56.03 -59.04 5.48 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 119.168 0.895 . . . . 0.0 110.44 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -14.96 12.09 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.3 -5.62 58.69 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 118.714 0.688 . . . . 0.0 109.573 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.96 -11.85 61.09 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 120.844 -1.16 . . . . 0.0 112.418 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.07 -8.12 46.84 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -167.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -138.18 62.72 1.56 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.486 1.914 . . . . 0.0 106.61 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.2 p -141.34 -176.13 4.6 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 120.611 -1.306 . . . . 0.0 110.97 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 8.1 m -144.81 -60.08 0.36 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.901 176.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.405 ' HA ' ' H ' ' A' ' 143' ' ' SER . 7.1 m95 68.68 159.54 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.128 1.371 . . . . 0.0 112.217 -176.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 t -136.61 129.38 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 52.1 tp -67.75 151.18 47.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 t -144.46 -23.36 0.53 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.06 146.13 29.9 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 121.202 1.819 . . . . 0.0 110.188 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.8 t90 -135.66 110.84 8.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.8 139.19 34.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -64.68 -170.17 0.05 OUTLIER 'General case' 0 C--O 1.237 0.436 0 CA-C-N 118.729 0.695 . . . . 0.0 110.559 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.71 -28.91 65.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.276 -1.515 . . . . 0.0 113.521 174.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -81.81 -45.47 15.53 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 123.242 1.496 . . . . 0.0 111.216 -165.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 140.81 -5.1 2.5 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 128.107 2.765 . . . . 0.0 112.709 -166.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -62.32 99.91 0.16 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.818 1.309 . . . . 0.0 109.689 167.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.73 122.29 12.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 159.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.7 156.05 35.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.82 146.56 53.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 162.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.6 m -141.31 156.29 67.45 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 161.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.608 1.539 . . . . 0.0 109.307 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.08 159.44 11.74 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.52 -1.363 . . . . 0.0 108.739 163.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.776 0.43 . . . . 0.0 111.552 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -19.78 66.05 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -65.86 -16.31 63.71 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.231 0.612 . . . . 0.0 112.638 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.29 -45.77 0.88 Allowed Glycine 0 C--N 1.337 0.628 0 C-N-CA 125.518 1.533 . . . . 0.0 111.174 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.39 86.7 2.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.565 -155.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.07 161.27 46.6 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.814 2.343 . . . . 0.0 111.634 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.3 mt -80.36 108.48 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 125.539 1.536 . . . . 0.0 109.05 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.2 p -91.85 169.79 10.4 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 122.178 0.989 . . . . 0.0 110.649 172.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -130.58 167.33 18.89 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 161.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.464 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 10.7 m -145.64 133.6 21.36 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 170.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.4 mt -133.0 82.15 1.98 Allowed 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 t -150.23 -154.97 0.59 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.942 1.297 . . . . 0.0 107.755 175.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.3 p -128.78 43.37 3.16 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.293 1.437 . . . . 0.0 111.993 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.8 t -57.16 -41.84 79.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.466 -1.396 . . . . 0.0 112.461 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.474 ' HG1' ' CD2' ' A' ' 64' ' ' HIS . 21.1 p -76.75 -31.62 57.21 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 120.415 -1.428 . . . . 0.0 110.259 172.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 124.19 -23.86 6.39 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 127.986 2.708 . . . . 0.0 111.243 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -82.44 165.33 20.32 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.693 1.246 . . . . 0.0 109.079 170.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -74.37 80.13 1.88 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.474 ' CD2' ' HG1' ' A' ' 60' ' ' THR . 0.2 OUTLIER -117.33 155.89 28.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 120.365 -1.46 . . . . 0.0 111.07 171.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.66 144.33 28.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 p -150.63 65.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 122.514 1.149 . . . . 0.0 110.23 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -103.57 -175.98 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.272 0.939 . . . . 0.0 111.394 -172.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.42 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 35.9 t80 -109.35 119.42 39.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 168.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.05 168.78 10.4 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 171.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.89 -42.73 8.0 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 -144.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 49.4 t -129.38 -5.96 4.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.596 1.198 . . . . 0.0 112.67 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.416 ' ND2' ' H ' ' A' ' 95' ' ' MET . 4.5 m120 -131.6 123.19 27.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.42 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.3 mtt-85 -56.98 169.77 0.49 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.088 0.555 . . . . 0.0 111.863 177.221 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -142.19 156.21 45.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.832 175.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -154.15 155.54 35.52 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.763 1.225 . . . . 0.0 109.206 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.75 -98.32 0.11 Allowed Glycine 0 C--O 1.228 -0.273 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 7.9 m -162.75 154.28 17.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.097 1.759 . . . . 0.0 108.017 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -139.11 167.55 21.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.462 1.028 . . . . 0.0 111.519 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.76 143.05 26.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.651 1.18 . . . . 0.0 108.298 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.64 116.35 28.97 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 166.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -150.99 162.06 41.55 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.811 1.245 . . . . 0.0 107.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 56.14 26.32 10.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.352 1.461 . . . . 0.0 113.612 166.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.83 21.08 65.0 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.463 -1.187 . . . . 0.0 112.814 -175.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 16.7 pttp -135.93 166.78 22.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.389 1.594 . . . . 0.0 112.18 -178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.28 145.12 44.24 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 164.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -141.6 161.85 36.91 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.175 -0.953 . . . . 0.0 108.762 167.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 90.6 m-85 -130.67 164.04 25.89 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.353 0.661 . . . . 0.0 111.107 -174.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.05 -151.68 26.89 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 125.171 1.367 . . . . 0.0 110.051 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 t -66.66 121.23 14.93 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 171.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -111.26 166.84 10.75 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.569 1.948 . . . . 0.0 110.852 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 163.86 -167.48 37.96 Favored Glycine 0 CA--C 1.523 0.574 0 O-C-N 121.774 -0.579 . . . . 0.0 111.784 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -178.86 -156.79 18.05 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 126.164 1.84 . . . . 0.0 109.209 -176.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.7 t -90.8 170.37 10.16 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.667 1.233 . . . . 0.0 108.768 160.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.2 mtm180 -118.06 85.56 2.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 164.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.416 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 15.1 mtm -82.2 154.45 25.44 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.41 122.79 30.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 57.4 m -123.86 -32.57 3.27 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 123.809 0.844 . . . . 0.0 111.761 -170.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 16.9 ptp 45.88 56.05 6.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.909 1.684 . . . . 0.0 111.854 -175.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.7 p -144.07 159.59 52.31 Favored Pre-proline 0 C--O 1.238 0.471 0 C-N-CA 124.079 0.952 . . . . 0.0 110.847 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.29 -29.57 13.91 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.765 2.31 . . . . 0.0 111.657 174.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.14 -7.08 84.23 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.316 -0.865 . . . . 0.0 111.102 167.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.95 -42.67 4.64 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 120.202 2.001 . . . . 0.0 111.549 173.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.66 -19.19 61.47 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 121.518 -0.989 . . . . 0.0 112.89 -172.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.6 tt -65.35 -15.86 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.516 1.126 . . . . 0.0 113.333 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.9 -50.12 19.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.736 1.214 . . . . 0.0 111.076 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.28 -19.56 71.61 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.634 -0.666 . . . . 0.0 113.228 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.3 -50.89 23.54 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.721 1.261 . . . . 0.0 108.307 169.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -63.09 -48.49 78.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.4 0.68 . . . . 0.0 110.252 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 30.3 mt -60.37 -27.74 67.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.031 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -68.2 -55.59 11.72 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.57 0.623 . . . . 0.0 109.61 171.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.89 69.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.671 1.189 . . . . 0.0 112.46 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.6 mt -65.58 -3.37 4.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.854 0.862 . . . . 0.0 113.215 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 65.9 p -102.42 11.65 37.69 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.519 1.054 . . . . 0.0 111.822 169.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -135.69 43.77 2.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.793 1.637 . . . . 0.0 110.656 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.1 mp -79.97 91.33 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 O-C-N 119.478 -2.014 . . . . 0.0 105.72 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.84 -27.83 24.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 168.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -147.19 165.84 28.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.389 2.676 . . . . 0.0 114.016 -172.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 12.1 t -161.0 163.62 31.57 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.994 1.318 . . . . 0.0 108.792 -178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.62 92.24 0.2 Allowed Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 108.394 -1.883 . . . . 0.0 108.394 172.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 93.0 t -80.73 125.22 39.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 119.412 1.606 . . . . 0.0 108.774 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.74 85.7 2.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.656 1.582 . . . . 0.0 107.933 -174.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -11.88 59.92 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.927 1.291 . . . . 0.0 113.74 -175.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.85 138.4 42.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.904 1.281 . . . . 0.0 109.01 160.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 150.87 97.55 Favored Pre-proline 0 N--CA 1.445 -0.692 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 164.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.28 119.73 4.5 Favored 'Cis proline' 0 N--CA 1.456 -0.721 0 N-CA-C 109.087 -1.159 . . . . 0.0 109.087 -12.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -62.59 132.01 50.94 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.566 0.747 . . . . 0.0 110.857 -167.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -143.1 170.9 14.85 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.182 1.393 . . . . 0.0 109.8 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 42.5 ttp -139.88 118.28 12.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.071 1.348 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -79.18 150.71 31.61 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 158.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 96.3 mt -116.78 147.78 41.77 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 153.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.76 131.07 73.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 10.9 mp -78.68 160.53 27.45 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -48.67 -36.63 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.877 -1.511 . . . . 0.0 112.38 171.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.49 -14.43 58.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.799 0.84 . . . . 0.0 110.27 -173.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 109.64 0.77 30.73 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.352 0.977 . . . . 0.0 114.183 -174.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.46 153.39 35.56 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.99 1.395 . . . . 0.0 109.563 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.5 m -132.25 104.5 6.79 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.754 -0.591 . . . . 0.0 109.925 -167.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -104.91 150.98 24.42 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 46.5 m -141.76 123.96 15.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.058 0.943 . . . . 0.0 109.716 -167.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -122.41 139.49 53.78 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.69 1.596 . . . . 0.0 109.438 -179.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.22 147.34 29.01 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.447 1.499 . . . . 0.0 108.536 168.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 101.24 6.62 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 120.671 -1.268 . . . . 0.0 109.457 168.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' SER . . . . . 0.405 ' H ' ' HA ' ' A' ' 28' ' ' TRP . 42.3 t -84.48 118.36 24.25 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 148.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.0 m -138.53 65.19 1.47 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.353 1.861 . . . . 0.0 106.462 152.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 126.853 2.061 . . . . 0.0 107.285 168.074 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 117.711 -1.138 . . . . 0.0 108.084 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.17 148.0 74.01 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.445 2.097 . . . . 0.0 110.999 -173.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -130.0 57.97 1.67 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.437 1.895 . . . . 0.0 108.145 -172.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 65.37 163.07 0.12 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.501 1.921 . . . . 0.0 112.24 -176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -70.32 -6.76 19.62 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 121.78 1.653 . . . . 0.0 113.469 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 71.3 175.71 0.29 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 128.675 2.79 . . . . 0.0 111.108 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.1 m -126.87 -178.96 4.59 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 127.832 2.453 . . . . 0.0 109.236 -168.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 44.45 56.15 5.21 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 127.457 2.303 . . . . 0.0 115.401 166.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.49 108.21 5.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.315 1.046 . . . . 0.0 108.293 174.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m -115.38 104.38 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.487 1.515 . . . . 0.0 109.201 171.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -146.85 160.84 39.55 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.763 1.225 . . . . 0.0 110.042 167.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -72.93 164.35 35.81 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 122.935 2.424 . . . . 0.0 110.865 170.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.48 148.1 62.57 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.077 1.351 . . . . 0.0 107.71 -179.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -65.95 -169.79 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 124.886 3.724 . . . . 0.0 113.432 167.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 73.58 163.33 0.27 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 128.896 2.878 . . . . 0.0 111.004 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -150.17 144.5 17.61 Favored Pre-proline 0 N--CA 1.435 -1.177 0 O-C-N 120.35 -1.469 . . . . 0.0 111.382 177.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.04 -41.0 10.56 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.825 2.35 . . . . 0.0 110.73 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.03 22.21 0.11 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.911 1.284 . . . . 0.0 112.289 175.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -103.08 -27.35 12.63 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 119.626 1.103 . . . . 0.0 111.832 160.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.0 m -70.91 -21.75 62.33 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.018 1.327 . . . . 0.0 112.998 -171.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -22.15 4.37 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.443 1.897 . . . . 0.0 113.445 165.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 mt -107.19 50.65 0.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.561 -171.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.3 mt -121.66 21.65 10.77 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.238 1.415 . . . . 0.0 110.27 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.39 -11.12 41.47 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.237 -0.915 . . . . 0.0 112.356 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -128.79 -6.63 5.07 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -83.06 -177.78 6.88 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.608 1.163 . . . . 0.0 112.833 -166.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -136.83 -64.87 0.57 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.056 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 66.28 162.5 0.16 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.012 1.725 . . . . 0.0 113.581 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.4 t -139.82 146.93 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -97.06 133.45 41.71 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.65 -3.76 1.85 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.61 149.81 27.03 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.925 1.239 . . . . 0.0 112.171 166.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.6 t90 -137.55 132.67 33.51 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.328 2.651 . . . . 0.0 108.154 176.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.33 147.15 46.06 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.124 1.769 . . . . 0.0 109.405 174.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -90.85 178.13 6.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.901 0.319 . . . . 0.0 110.301 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.52 69.35 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.966 0.506 . . . . 0.0 112.318 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -100.2 18.95 17.42 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.052 0.454 . . . . 0.0 110.793 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.6 8.83 79.74 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.018 -1.676 . . . . 0.0 112.268 170.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -66.41 100.98 0.69 Allowed 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 125.728 1.611 . . . . 0.0 108.181 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.4 106.11 1.64 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.457 1.026 . . . . 0.0 109.882 168.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -64.7 156.06 31.54 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.572 0.749 . . . . 0.0 110.183 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 142.46 54.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 167.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.5 m -144.23 159.52 52.06 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 125.656 1.583 . . . . 0.0 108.039 168.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -75.21 115.1 4.16 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.998 2.465 . . . . 0.0 110.435 171.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 166.83 12.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.49 1.916 . . . . 0.0 109.34 166.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.25 -52.42 65.67 Favored 'General case' 0 C--O 1.23 0.07 0 O-C-N 121.87 -0.519 . . . . 0.0 111.44 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -8.4 26.17 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.33 -15.41 50.14 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 120.892 -1.13 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.66 -81.27 0.27 Allowed Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.45 85.48 7.21 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 125.497 1.519 . . . . 0.0 107.998 -174.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -67.73 164.07 32.77 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.829 2.353 . . . . 0.0 110.443 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.463 HG12 ' H ' ' A' ' 70' ' ' GLY . 41.0 mt -79.85 107.03 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.3 p -113.43 129.95 56.42 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.3 tp -95.43 155.34 16.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.783 1.633 . . . . 0.0 106.598 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m -144.76 118.52 9.25 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.8 mt -117.12 85.59 2.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 -174.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.38 172.45 12.93 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.799 0.84 . . . . 0.0 110.231 -172.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.0 p -103.1 24.58 10.61 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.664 1.586 . . . . 0.0 112.873 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.94 -47.09 52.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.701 1.591 . . . . 0.0 112.616 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -74.6 3.03 8.43 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 118.995 0.816 . . . . 0.0 112.995 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.92 -27.36 20.78 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 127.388 2.423 . . . . 0.0 111.829 -171.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -120.27 152.7 37.4 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 118.316 1.058 . . . . 0.0 111.16 -172.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.1 ptp85 -65.6 96.88 0.28 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.59 154.27 49.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.242 1.017 . . . . 0.0 109.204 170.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.55 111.75 23.51 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.947 -1.871 . . . . 0.0 105.947 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.1 p -124.58 86.61 2.59 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.139 1.376 . . . . 0.0 108.354 -169.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 168.13 24.91 Favored Glycine 0 N--CA 1.469 0.873 0 O-C-N 120.994 -1.066 . . . . 0.0 111.514 -163.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 22.8 t80 -95.31 102.43 14.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 123.846 0.858 . . . . 0.0 109.752 -177.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 p -93.28 99.27 11.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 119.161 0.891 . . . . 0.0 109.001 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.463 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 75.07 -70.36 1.82 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 124.497 1.046 . . . . 0.0 112.784 166.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 28.3 t -130.94 -14.27 3.51 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.858 1.263 . . . . 0.0 112.797 175.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.499 ' ND2' ' H ' ' A' ' 95' ' ' MET . 7.2 m120 -133.87 133.79 41.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -165.566 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -71.18 138.26 49.41 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 118.29 -1.364 . . . . 0.0 109.273 170.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -103.17 162.89 12.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.969 2.043 . . . . 0.0 109.409 168.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.96 161.61 41.97 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.752 2.021 . . . . 0.0 107.232 167.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -171.92 -108.92 0.22 Allowed Glycine 0 C--N 1.334 0.456 0 O-C-N 121.927 -0.483 . . . . 0.0 112.373 169.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.0 m -154.37 168.71 25.72 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 127.278 2.231 . . . . 0.0 106.795 166.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -142.48 171.56 13.89 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.088 0.555 . . . . 0.0 110.184 162.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -146.58 152.17 38.5 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.34 1.856 . . . . 0.0 107.868 170.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.8 128.39 45.9 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 172.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -164.23 164.36 22.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 125.732 1.613 . . . . 0.0 108.639 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.88 4.88 2.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.33 6.08 89.43 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 118.576 -1.124 . . . . 0.0 112.316 -166.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.4 pttp -123.24 168.27 12.66 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 126.34 1.856 . . . . 0.0 110.846 -173.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.64 135.45 35.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 169.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.29 131.48 55.76 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 165.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -97.97 161.32 13.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 171.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.09 -147.9 16.83 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -57.59 99.99 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.532 0.733 . . . . 0.0 109.049 167.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 61.2 mt -98.24 142.8 29.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.069 1.348 . . . . 0.0 108.599 170.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.15 -177.01 48.32 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.08 -168.55 32.11 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -172.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.9 p -75.61 173.32 11.2 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.988 2.515 . . . . 0.0 112.468 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -122.02 84.2 2.22 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 126.12 1.768 . . . . 0.0 108.899 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.499 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 11.0 mtt -73.68 -174.48 1.77 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.21 1.404 . . . . 0.0 108.155 159.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -142.63 109.77 5.59 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 120.824 1.647 . . . . 0.0 111.658 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 68.2 m -93.98 -14.79 25.52 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.764 -1.112 . . . . 0.0 112.442 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp 47.34 28.12 1.01 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.973 1.709 . . . . 0.0 114.824 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -117.57 164.33 19.94 Favored Pre-proline 0 C--O 1.239 0.513 0 C-N-CA 126.432 1.893 . . . . 0.0 109.936 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.92 -14.85 26.5 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.244 1.963 . . . . 0.0 113.788 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.31 -2.26 74.01 Favored Glycine 0 C--O 1.222 -0.604 0 CA-C-O 117.675 -1.625 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.75 -58.62 1.59 Allowed Glycine 0 C--N 1.337 0.587 0 CA-C-N 119.958 1.879 . . . . 0.0 112.803 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.07 -3.59 20.6 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -173.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -65.15 -10.48 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.135 0.974 . . . . 0.0 112.317 171.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -44.61 -60.68 1.87 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.265 1.426 . . . . 0.0 110.68 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.85 -30.11 77.1 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 118.501 -1.166 . . . . 0.0 112.333 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.45 -43.91 76.04 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.306 1.553 . . . . 0.0 109.845 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.72 -49.01 74.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.999 0.92 . . . . 0.0 109.758 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.39 -36.03 75.05 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.465 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -51.95 61.99 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.191 0.996 . . . . 0.0 110.123 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.79 -30.46 68.0 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.534 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.45 -22.11 65.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.379 1.472 . . . . 0.0 112.527 177.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.0 p -73.08 -27.51 61.76 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.544 -0.722 . . . . 0.0 111.157 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -114.96 49.57 1.04 Allowed 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 126.26 1.824 . . . . 0.0 110.05 -165.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.5 mm -75.41 69.15 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 166.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.64 -32.7 60.32 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 120.818 -1.176 . . . . 0.0 109.286 177.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -133.67 160.18 38.31 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.554 1.542 . . . . 0.0 110.366 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -155.47 166.5 33.35 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.131 -0.981 . . . . 0.0 109.886 -162.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.55 76.1 0.09 OUTLIER Glycine 0 CA--C 1.531 1.069 0 CA-C-N 118.61 0.641 . . . . 0.0 113.131 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . 0.255 5.2 p -86.17 127.17 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.173 -1.781 . . . . 0.0 110.314 171.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -99.58 80.71 2.4 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.367 1.467 . . . . 0.0 107.041 173.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.406 ' HG3' HE21 ' A' ' 126' ' ' GLN . 27.8 ttm -82.18 63.38 6.36 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.843 1.656 . . . . 0.0 110.966 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -139.32 130.01 25.98 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 165.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.45 137.16 16.69 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 168.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.61 122.06 7.12 Favored 'Cis proline' 0 CA--C 1.542 0.876 0 CA-C-N 119.419 0.828 . . . . 0.0 111.383 -6.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . 0.406 HE21 ' HG3' ' A' ' 122' ' ' MET . 58.6 mt-30 -75.7 135.77 40.38 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.376 1.07 . . . . 0.0 110.93 -169.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -146.19 176.19 9.93 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 125.972 1.709 . . . . 0.0 108.839 165.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -141.7 134.09 28.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.076 1.75 . . . . 0.0 108.027 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -112.22 155.25 24.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 126.611 1.964 . . . . 0.0 109.329 172.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.413 ' CD1' ' HB2' ' A' ' 138' ' ' LEU 0.266 0.0 OUTLIER -138.78 155.39 48.22 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 127.127 2.171 . . . . 0.0 109.904 162.526 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.5 t -134.06 136.59 53.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 177.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -88.2 174.26 8.32 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 122.154 0.978 . . . . 0.0 111.287 -174.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -54.41 -39.71 67.55 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.619 1.968 . . . . 0.0 111.882 163.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -84.23 -20.81 31.64 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 126.491 1.916 . . . . 0.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 95.87 20.82 25.17 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-O 118.837 -0.98 . . . . 0.0 114.369 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.82 155.91 3.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.032 1.416 . . . . 0.0 108.729 163.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.06 110.55 11.71 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 126.037 1.735 . . . . 0.0 106.676 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.413 ' HB2' ' CD1' ' A' ' 130' ' ' LEU . 0.5 OUTLIER -116.61 150.38 38.17 Favored 'General case' 0 CA--C 1.515 -0.366 0 O-C-N 121.451 -0.781 . . . . 0.0 109.239 -172.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 38.7 m -138.4 103.79 4.99 Favored 'General case' 0 C--O 1.239 0.541 0 O-C-N 124.277 0.986 . . . . 0.0 111.419 -162.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -92.59 168.8 10.99 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.707 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.39 143.58 47.37 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 126.573 1.949 . . . . 0.0 107.698 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -75.76 104.02 6.12 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.539 -1.351 . . . . 0.0 108.978 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 2.6 t -99.3 115.84 30.09 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 150.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 p -128.06 1.1 5.89 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.87 1.268 . . . . 0.0 112.629 156.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 C--O 1.258 1.547 0 C-N-CA 131.239 3.815 . . . . 0.0 104.164 -167.54 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 13.0 pt . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -67.12 -177.27 0.99 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 121.719 1.613 . . . . 0.0 109.942 166.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.96 172.57 12.57 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 163.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -138.64 160.52 63.03 Favored Pre-proline 0 C--N 1.327 -0.378 0 C-N-CA 126.179 1.791 . . . . 0.0 107.661 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -76.23 95.14 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.003 2.469 . . . . 0.0 108.574 168.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -133.61 169.46 16.96 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 159.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.3 m -111.62 159.28 18.32 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.667 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 14.39 30.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.968 0.889 . . . . 0.0 112.553 -176.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.88 34.52 0.67 Allowed 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.476 1.11 . . . . 0.0 112.168 -168.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.05 152.46 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 126.954 2.101 . . . . 0.0 108.193 -172.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -140.81 157.02 68.54 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 126.869 2.067 . . . . 0.0 108.045 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -73.95 173.48 13.96 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.434 2.756 . . . . 0.0 110.991 -176.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.34 159.96 45.43 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 124.453 1.101 . . . . 0.0 110.644 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -76.3 176.12 10.47 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 123.543 2.828 . . . . 0.0 111.947 -175.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 55.02 54.32 9.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.76 1.224 . . . . 0.0 111.055 174.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 156.98 45.37 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 123.698 0.799 . . . . 0.0 111.627 -176.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.89 -38.0 31.77 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.898 3.065 . . . . 0.0 112.883 176.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.8 19.61 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.449 2.3 . . . . 0.0 115.468 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.84 -8.64 1.39 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.46 1.504 . . . . 0.0 113.261 -170.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.5 m -79.53 -19.37 49.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.971 1.26 . . . . 0.0 112.801 175.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -57.03 -19.23 17.57 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.124 1.329 . . . . 0.0 113.702 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 3.84 51.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.72 0.691 . . . . 0.0 110.388 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.3 mt -84.99 66.19 9.63 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.492 1.042 . . . . 0.0 110.633 -175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -120.48 -48.35 2.3 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 124.125 0.97 . . . . 0.0 112.502 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -127.95 57.8 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.2 p -139.98 160.89 38.9 Favored 'General case' 0 C--N 1.337 0.055 0 CA-C-O 122.084 0.945 . . . . 0.0 110.63 -173.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.595 ' H ' ' NH1' ' A' ' 142' ' ' ARG . 3.2 p -142.49 136.43 29.38 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 124.123 0.969 . . . . 0.0 109.008 -158.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 47.8 m95 -149.97 165.22 33.31 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.855 0.722 . . . . 0.0 109.901 -165.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 70.4 t -142.01 123.53 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.52 130.84 45.21 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.55 -6.08 2.54 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.552 0.533 . . . . 0.0 111.918 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.9 162.13 36.87 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.019 -1.051 . . . . 0.0 110.918 169.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -145.76 116.69 7.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.63 138.72 38.24 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 174.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -71.28 167.27 19.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 118.574 0.625 . . . . 0.0 109.344 167.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.4 -30.16 70.38 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.18 0.592 . . . . 0.0 112.393 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -74.86 -45.07 45.49 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.69 3.47 1.78 Allowed Glycine 0 CA--C 1.531 1.035 0 CA-C-O 119.118 -0.823 . . . . 0.0 113.792 -172.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.6 m -65.04 101.63 0.53 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.377 2.089 . . . . 0.0 108.379 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.86 108.41 0.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.028 -1.045 . . . . 0.0 109.398 165.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -66.65 161.83 22.47 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.098 0.959 . . . . 0.0 110.446 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.38 145.34 39.48 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 158.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 m -140.49 165.42 30.22 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.424 1.89 . . . . 0.0 107.561 168.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.97 127.44 13.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 CA-C-N 120.556 1.234 . . . . 0.0 110.884 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.77 162.44 16.04 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.819 1.248 . . . . 0.0 112.002 164.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.15 -36.63 61.06 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.497 -0.752 . . . . 0.0 110.443 164.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.9 -21.06 60.21 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.936 0.895 . . . . 0.0 112.957 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -70.36 -11.86 61.2 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.574 -0.704 . . . . 0.0 112.523 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.1 -1.63 38.05 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 118.437 -1.202 . . . . 0.0 113.389 175.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -169.6 83.6 0.62 Allowed Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.844 1.258 . . . . 0.0 111.064 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.6 157.09 63.27 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 121.97 1.78 . . . . 0.0 110.357 171.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 32.2 mt -87.25 111.55 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.1 p -123.37 132.29 53.93 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -169.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.1 tp -111.58 134.5 53.11 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 124.993 1.317 . . . . 0.0 108.527 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.1 m -124.14 140.65 52.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 167.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.4 mt -123.3 121.56 36.15 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.9 t -172.67 -174.26 1.12 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.2 p -113.5 36.05 3.76 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.067 1.347 . . . . 0.0 112.545 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.8 m -49.12 -14.63 0.08 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 170.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -113.07 3.12 15.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.295 1.407 . . . . 0.0 111.096 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.02 -13.23 39.13 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 119.902 1.228 . . . . 0.0 111.692 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -113.67 166.07 11.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 121.232 -1.157 . . . . 0.0 110.422 164.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -55.47 115.78 2.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.642 1.177 . . . . 0.0 110.046 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.96 168.86 19.25 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.273 1.029 . . . . 0.0 108.403 176.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.13 73.47 1.45 Allowed 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.443 1.097 . . . . 0.0 109.12 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 t -68.98 116.42 9.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.73 175.84 25.03 Favored Glycine 0 C--N 1.328 0.087 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -167.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -129.56 106.87 9.04 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.3 m -78.05 -177.14 4.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.126 0.971 . . . . 0.0 108.796 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.98 -30.5 1.75 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 126.277 1.894 . . . . 0.0 117.324 -163.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.8 OUTLIER -147.58 6.88 0.84 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 119.403 1.601 . . . . 0.0 114.502 156.282 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -134.05 122.29 22.75 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -160.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -69.12 146.78 52.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.232 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -130.58 166.15 21.23 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 126.238 1.815 . . . . 0.0 109.422 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.1 ptp -154.7 163.21 40.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.448 1.899 . . . . 0.0 108.066 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 154.41 172.04 21.9 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 46.1 p -94.6 153.74 17.7 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.156 1.382 . . . . 0.0 111.589 -170.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -108.99 166.29 10.94 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.497 0.665 . . . . 0.0 110.764 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.11 122.2 7.7 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.112 1.365 . . . . 0.0 107.862 177.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.1 mt -101.47 111.84 24.2 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.565 1.546 . . . . 0.0 107.876 -172.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -154.52 163.53 40.06 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.171 1.788 . . . . 0.0 108.807 -175.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.7 29.24 2.11 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.694 2.398 . . . . 0.0 116.953 163.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.16 11.73 71.1 Favored Glycine 0 CA--C 1.533 1.196 0 O-C-N 120.85 -1.156 . . . . 0.0 113.228 -174.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -129.6 165.65 21.32 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.737 2.415 . . . . 0.0 112.242 -170.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.89 92.07 3.63 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.5 t -86.69 167.14 14.76 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -129.44 173.56 10.44 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.413 1.085 . . . . 0.0 110.702 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -106.34 -136.75 8.46 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 127.783 2.611 . . . . 0.0 108.942 170.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.9 m -64.42 83.65 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.771 1.629 . . . . 0.0 111.546 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.0 mt -77.02 143.33 39.43 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 120.848 -1.157 . . . . 0.0 108.929 169.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.83 -176.63 46.33 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.68 -141.66 3.27 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.518 0.659 . . . . 0.0 112.347 -159.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.7 t -115.53 168.22 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 169.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -126.71 90.8 3.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 171.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtm -102.68 172.85 6.61 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.78 107.12 8.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.542 1.519 . . . . 0.0 111.796 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.7 m -79.22 -7.18 58.05 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.183 0.993 . . . . 0.0 113.544 170.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 66.51 20.79 10.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.235 1.814 . . . . 0.0 113.227 176.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 p -127.03 161.31 54.58 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.099 1.76 . . . . 0.0 110.978 -170.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -37.4 5.68 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.37 2.047 . . . . 0.0 111.034 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.49 -30.5 75.11 Favored Glycine 0 C--O 1.22 -0.753 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.361 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -60.8 8.3 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.116 1.458 . . . . 0.0 109.889 167.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -81.82 1.86 32.82 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -164.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tt -78.99 -7.73 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.195 -0.941 . . . . 0.0 110.43 166.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.46 -59.28 2.5 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.689 1.596 . . . . 0.0 111.842 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.84 87.93 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 119.155 -0.803 . . . . 0.0 111.213 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.19 84.39 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 118.267 1.034 . . . . 0.0 109.985 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -64.38 -43.76 93.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.464 -0.779 . . . . 0.0 109.942 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.3 -38.02 76.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.885 1.221 . . . . 0.0 110.011 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -19.21 65.86 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.211 1.005 . . . . 0.0 113.631 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.6 -25.16 23.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.687 0.795 . . . . 0.0 110.681 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.78 11.62 3.77 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.908 1.283 . . . . 0.0 113.126 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.86 -5.99 15.36 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 125.667 1.587 . . . . 0.0 111.306 164.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -126.31 66.66 1.22 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.684 1.194 . . . . 0.0 108.415 -172.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.1 mp -101.31 31.56 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 120.959 -1.088 . . . . 0.0 110.592 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -54.42 -29.06 48.0 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.232 -1.542 . . . . 0.0 113.435 -168.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -125.79 163.67 22.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.449 1.5 . . . . 0.0 110.02 170.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 93.6 m -157.97 165.81 34.18 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.355 1.462 . . . . 0.0 107.104 176.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -161.88 127.42 1.72 Allowed Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 169.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.74 142.35 16.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 118.874 1.337 . . . . 0.0 108.097 171.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.86 75.58 2.39 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 172.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.9 ttm -77.25 73.52 3.83 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.8 1.24 . . . . 0.0 107.757 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.5 140.22 12.37 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 171.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.2 132.19 95.01 Favored Pre-proline 0 N--CA 1.446 -0.674 0 N-CA-C 108.031 -1.099 . . . . 0.0 108.031 173.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -78.49 120.63 7.36 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 CA-C-N 119.925 1.009 . . . . 0.0 111.647 -1.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.67 131.18 45.11 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.56 0.695 . . . . 0.0 110.981 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -146.11 164.08 33.31 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.615 1.566 . . . . 0.0 106.948 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -138.48 147.96 43.8 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 125.842 1.657 . . . . 0.0 107.26 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -130.11 141.99 50.64 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 166.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.36 161.33 14.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 160.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.0 t -136.07 121.42 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.06 170.4 11.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.236 0.541 . . . . 0.0 111.158 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 46.1 p-10 -64.52 -26.11 68.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.481 169.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.58 -37.41 62.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 119.703 1.138 . . . . 0.0 108.848 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.53 10.92 9.94 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.373 -173.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -55.65 151.02 11.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 120.332 2.066 . . . . 0.0 108.628 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.6 m -130.41 96.67 4.2 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.802 0.841 . . . . 0.0 109.065 -175.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.04 133.07 36.82 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.623 1.169 . . . . 0.0 107.867 169.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.9 m -108.65 128.62 55.01 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.438 1.095 . . . . 0.0 109.431 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.87 131.07 54.19 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.725 1.21 . . . . 0.0 109.311 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.43 148.12 26.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.823 1.249 . . . . 0.0 109.62 172.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.595 ' NH1' ' H ' ' A' ' 27' ' ' SER . 34.0 tpt85 -70.26 132.94 46.48 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.737 -1.125 . . . . 0.0 108.423 173.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -133.87 60.91 1.69 Allowed 'General case' 0 C--N 1.347 0.47 0 CA-C-N 120.338 1.426 . . . . 0.0 110.517 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 3.77 7.92 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 ttm-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.195 1.398 . . . . 0.0 112.97 -169.804 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.74 175.48 4.42 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.469 2.112 . . . . 0.0 110.713 168.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.483 ' H ' ' CD2' ' A' ' 4' ' ' HIS . 54.7 mtmt -140.68 34.73 1.81 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.968 1.707 . . . . 0.0 108.844 173.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.483 ' CD2' ' H ' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -171.7 161.11 4.87 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.269 1.828 . . . . 0.0 109.882 -162.678 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.39 -7.97 17.13 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.777 2.985 . . . . 0.0 112.697 169.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.54 21.34 11.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.242 2.217 . . . . 0.0 113.095 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.3 p -153.93 179.97 8.41 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.061 1.345 . . . . 0.0 109.897 174.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -130.59 82.64 2.07 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.557 1.543 . . . . 0.0 107.496 -175.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.85 90.71 3.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.609 1.564 . . . . 0.0 107.009 170.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -129.5 100.45 5.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.67 163.7 31.17 Favored Pre-proline 0 CA--C 1.535 0.385 0 C-N-CA 126.627 1.971 . . . . 0.0 108.411 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -68.4 137.45 39.76 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.025 1.817 . . . . 0.0 108.663 168.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -84.28 144.28 43.45 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.99 -166.78 0.43 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.17 2.58 . . . . 0.0 114.173 -166.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 63.27 77.53 0.32 Allowed 'General case' 0 C--N 1.342 0.281 0 C-N-CA 128.287 2.635 . . . . 0.0 110.896 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.82 144.45 89.94 Favored Pre-proline 0 N--CA 1.469 0.502 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.917 -177.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.53 -14.74 30.73 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 123.38 2.72 . . . . 0.0 112.528 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.64 31.9 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.405 1.882 . . . . 0.0 112.169 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -131.64 -28.3 1.84 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.741 -1.225 . . . . 0.0 112.213 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.5 m -67.26 -17.23 64.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.994 0.815 . . . . 0.0 110.978 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -59.47 -11.26 4.22 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.961 1.304 . . . . 0.0 114.186 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.1 mt -106.6 7.72 30.85 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.526 1.53 . . . . 0.0 111.581 -172.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.37 51.8 0.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.121 1.368 . . . . 0.0 110.816 -172.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.45 0.95 0.81 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -165.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.0 -7.95 12.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.684 0.793 . . . . 0.0 111.451 148.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 80.8 p -73.83 -176.7 2.53 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.956 0.884 . . . . 0.0 112.047 -155.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -149.52 -68.42 0.21 Allowed 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.114 -2.241 . . . . 0.0 110.61 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.6 m95 69.78 163.44 0.24 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.822 1.249 . . . . 0.0 112.841 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.4 t -143.51 119.55 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.58 136.69 57.72 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.38 -11.51 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.95 151.37 28.44 Favored 'General case' 0 CA--C 1.515 -0.392 0 O-C-N 120.415 -1.428 . . . . 0.0 109.39 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -132.34 107.46 8.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -91.72 140.7 29.46 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -68.84 163.84 23.33 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.589 0.756 . . . . 0.0 110.372 166.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.52 69.82 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.708 0.803 . . . . 0.0 112.337 171.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -77.84 -21.22 51.8 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.502 0.592 . . . . 0.0 112.091 177.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.72 6.07 23.45 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.735 1.159 . . . . 0.0 114.669 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -68.28 115.41 7.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.877 2.071 . . . . 0.0 108.592 171.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.59 107.32 4.4 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.787 -1.196 . . . . 0.0 110.423 167.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.0 mtt180 -65.6 149.28 50.34 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.716 0.806 . . . . 0.0 110.18 173.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.97 139.59 58.78 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.104 0.562 . . . . 0.0 109.724 166.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -139.12 160.86 60.72 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 127.45 2.3 . . . . 0.0 108.574 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.78 116.06 4.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.532 2.155 . . . . 0.0 110.822 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.63 168.52 17.51 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.865 0.84 . . . . 0.0 111.597 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.26 -38.91 81.27 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.826 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -87.93 15.85 6.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.292 1.437 . . . . 0.0 111.597 176.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -105.76 -27.6 11.18 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.471 161.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.93 -27.33 3.67 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 123.545 0.593 . . . . 0.0 114.364 157.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -136.34 73.04 57.73 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 125.049 1.34 . . . . 0.0 110.101 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.11 143.54 78.56 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.858 1.705 . . . . 0.0 108.118 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 83.9 mt -70.83 99.56 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 125.526 1.53 . . . . 0.0 109.27 -169.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -87.41 149.85 24.19 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 126.544 1.938 . . . . 0.0 107.778 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 21.3 tp -127.87 157.8 39.52 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.299 1.44 . . . . 0.0 107.906 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.62 108.32 4.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.42 108.85 19.88 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 169.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 t -149.68 174.69 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.04 35.22 4.82 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.079 0.952 . . . . 0.0 109.924 171.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.2 t -48.35 -52.54 21.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.112 0.965 . . . . 0.0 110.224 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.5 t -84.52 10.23 11.48 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.656 1.182 . . . . 0.0 111.778 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.85 -38.63 2.82 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 127.016 2.246 . . . . 0.0 111.476 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -73.43 150.29 41.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 173.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -72.25 98.47 2.18 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 167.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.44 152.84 45.85 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 122.438 1.113 . . . . 0.0 110.375 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.93 133.37 41.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 153.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 53.5 p -116.24 172.0 7.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 141.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.93 175.1 39.27 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -109.64 94.62 5.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.6 m -73.56 80.21 1.47 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.697 0.761 . . . . 0.0 109.643 175.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.18 -51.57 4.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 124.388 0.994 . . . . 0.0 112.695 155.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -152.48 14.18 0.57 Allowed 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.924 -0.751 . . . . 0.0 111.873 153.56 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.7 110.32 6.71 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.775 -1.203 . . . . 0.0 108.304 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 136.06 40.45 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.957 1.703 . . . . 0.0 113.981 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -112.03 168.33 9.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 126.243 1.817 . . . . 0.0 110.788 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -152.73 156.72 39.69 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.142 1.777 . . . . 0.0 107.338 166.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -170.37 -109.29 0.22 Allowed Glycine 0 CA--C 1.525 0.711 0 O-C-N 121.622 -0.674 . . . . 0.0 111.883 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.6 168.88 22.69 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.405 1.482 . . . . 0.0 107.917 174.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -152.12 169.39 22.52 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.639 1.176 . . . . 0.0 110.661 170.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.18 157.15 42.3 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.77 1.628 . . . . 0.0 109.451 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.26 138.81 47.25 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.253 1.021 . . . . 0.0 108.834 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -162.31 164.69 27.36 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.922 2.089 . . . . 0.0 108.321 167.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.5 t0 51.67 32.83 9.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 162.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.34 29.43 63.21 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.197 -0.94 . . . . 0.0 113.332 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -128.54 154.79 45.78 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 128.173 2.589 . . . . 0.0 110.93 -175.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -114.48 99.52 7.62 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 178.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -100.85 153.22 19.67 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 -175.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -115.52 161.68 18.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.008 0.909 . . . . 0.0 110.087 -171.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.51 -168.09 37.9 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 108.693 -1.763 . . . . 0.0 108.693 159.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.85 149.97 34.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 165.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.8 mt -126.16 171.73 10.63 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.574 1.55 . . . . 0.0 110.568 -170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.78 175.99 37.42 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 124.034 0.826 . . . . 0.0 111.081 164.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -159.43 -115.77 0.42 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.0 t -115.12 -175.1 2.62 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 129.793 3.237 . . . . 0.0 109.872 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.2 mmt180 -141.98 56.05 1.48 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.465 1.906 . . . . 0.0 108.337 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.97 159.01 31.53 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.265 -0.897 . . . . 0.0 109.753 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.9 112.18 23.84 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.989 1.316 . . . . 0.0 110.305 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.1 m -117.49 -9.34 10.86 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -176.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 55.7 mtm 61.03 22.37 12.63 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.148 0.979 . . . . 0.0 112.844 171.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.3 p -114.18 154.43 46.24 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 126.303 1.841 . . . . 0.0 108.988 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.57 -40.95 21.31 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 120.891 1.061 . . . . 0.0 109.522 170.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -70.54 -5.62 56.25 Favored Glycine 0 C--O 1.22 -0.742 0 CA-C-O 116.824 -2.098 . . . . 0.0 113.841 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.25 -57.88 3.3 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 120.933 2.367 . . . . 0.0 109.784 168.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.36 -15.88 63.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.05 0.94 . . . . 0.0 111.846 -167.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.53 -6.13 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.716 0.806 . . . . 0.0 111.68 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -44.26 -52.57 7.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.706 1.139 . . . . 0.0 110.44 165.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -60.77 -46.36 94.65 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 119.934 -0.37 . . . . 0.0 112.498 -173.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.47 85.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.188 0.494 . . . . 0.0 109.81 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -68.64 -47.06 67.55 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.228 -0.92 . . . . 0.0 111.016 -173.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.01 -29.32 68.4 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.763 0.71 . . . . 0.0 111.017 173.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -42.02 90.91 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.084 0.554 . . . . 0.0 111.293 171.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.35 65.22 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.651 0.78 . . . . 0.0 112.111 -173.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.83 -12.52 61.32 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.781 169.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 12.1 p -93.78 13.96 20.79 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.547 1.521 . . . . 0.0 112.311 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -141.11 28.72 1.87 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.53 1.059 . . . . 0.0 111.804 -171.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.9 mm -71.56 80.57 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 125.441 1.497 . . . . 0.0 107.447 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -80.27 -34.67 36.84 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 165.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -125.4 164.04 21.29 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.101 0.96 . . . . 0.0 110.576 -176.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 53.7 m -160.87 145.28 13.82 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.04 91.78 0.15 Allowed Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 108.229 -1.949 . . . . 0.0 108.229 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . 0.266 4.5 p -87.59 132.46 32.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.389 1.094 . . . . 0.0 110.091 165.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -98.42 88.52 4.15 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 166.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 51.8 tpp -82.67 57.48 3.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 174.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -145.08 116.51 8.04 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.27 125.48 14.97 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-O 117.297 -1.335 . . . . 0.0 109.517 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 115.2 3.41 Favored 'Cis proline' 0 CA--C 1.538 0.691 0 O-C-N 122.933 0.965 . . . . 0.0 112.706 5.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -78.82 129.71 34.89 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -167.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.67 160.29 41.44 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.443 1.497 . . . . 0.0 108.424 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 46.6 ttp -134.09 127.11 31.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -123.61 109.72 14.11 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.813 0.845 . . . . 0.0 108.737 -174.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 16.3 mt -94.04 143.49 26.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -131.85 136.29 57.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.2 mp -95.33 171.27 8.81 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.625 0.726 . . . . 0.0 110.497 -174.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -53.31 -27.47 23.3 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 112.621 168.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -90.66 -16.56 28.38 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.193 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 105.99 8.35 34.25 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.693 -1.615 . . . . 0.0 115.607 177.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.18 165.45 0.09 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 120.063 1.931 . . . . 0.0 110.842 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.3 m -142.11 95.86 2.87 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 120.243 -1.536 . . . . 0.0 109.67 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.0 mp -86.92 146.72 26.06 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.156 -0.965 . . . . 0.0 108.68 173.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.4 m -125.46 125.23 43.0 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.94 1.296 . . . . 0.0 109.038 -176.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -123.07 135.01 54.23 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.322 1.049 . . . . 0.0 110.084 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -81.54 147.51 29.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.912 1.285 . . . . 0.0 108.338 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.8 tpt85 -76.26 100.42 5.08 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.694 -1.254 . . . . 0.0 108.94 165.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 20.7 t -75.76 127.65 33.48 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 146.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -131.47 17.2 4.88 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.455 1.902 . . . . 0.0 112.853 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 . . . . . 0 C--O 1.251 1.181 0 CA-C-N 118.872 0.76 . . . . 0.0 110.065 170.145 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.66 169.21 22.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.853 1.702 . . . . 0.0 109.552 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 106.77 17.24 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 170.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -101.53 165.48 13.98 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 125.704 1.602 . . . . 0.0 107.802 162.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.12 86.37 0.25 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.143 2.562 . . . . 0.0 110.019 170.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -141.23 175.03 9.97 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 130.347 3.459 . . . . 0.0 106.432 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.3 m -44.34 143.48 1.24 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 129.672 3.189 . . . . 0.0 111.932 172.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -87.89 14.43 8.85 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 172.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.29 75.07 9.89 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.3 m -133.88 154.86 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 126.68 1.992 . . . . 0.0 107.758 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.82 154.81 79.75 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.867 0.867 . . . . 0.0 109.307 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.22 165.98 26.76 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.821 2.347 . . . . 0.0 112.537 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.28 165.17 7.12 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.635 1.574 . . . . 0.0 110.205 170.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -76.64 -178.17 4.3 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 123.312 2.675 . . . . 0.0 113.034 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 75.29 86.52 0.09 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 128.415 2.686 . . . . 0.0 113.392 163.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.2 144.27 31.87 Favored Pre-proline 0 N--CA 1.472 0.66 0 C-N-CA 124.533 1.133 . . . . 0.0 111.158 -174.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -84.8 -18.51 4.47 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 124.215 3.277 . . . . 0.0 112.577 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.81 -10.36 8.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.992 0.917 . . . . 0.0 113.022 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -101.38 -2.37 31.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.409 2.284 . . . . 0.0 112.611 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.1 m -60.69 -57.21 13.67 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.098 1.317 . . . . 0.0 111.598 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.68 -18.14 0.65 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -80.78 5.25 16.42 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.125 1.37 . . . . 0.0 111.262 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.6 61.71 3.74 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 119.546 -1.971 . . . . 0.0 111.575 -173.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.24 -52.35 1.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 118.764 0.711 . . . . 0.0 112.646 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.0 -4.79 57.24 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.919 0.781 . . . . 0.0 111.79 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.5 -177.1 2.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.487 1.115 . . . . 0.0 111.499 -173.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.3 m -142.95 -57.73 0.43 Allowed 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.082 -1.636 . . . . 0.0 112.845 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 9.0 m95 69.83 165.68 0.27 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.342 1.857 . . . . 0.0 112.293 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -143.14 137.69 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -79.5 132.06 36.22 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 175.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.3 t -126.24 -17.05 5.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.38 158.35 34.08 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.653 1.115 . . . . 0.0 111.097 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -139.06 95.04 2.88 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.737 1.615 . . . . 0.0 108.672 -176.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.95 146.16 46.25 Favored 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 121.441 -0.787 . . . . 0.0 110.439 174.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.446 ' C ' ' H ' ' A' ' 37' ' ' ASP . 28.3 mt-30 -80.23 166.49 21.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.096 1.358 . . . . 0.0 109.645 166.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.29 14.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.84 2.056 . . . . 0.0 113.497 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.446 ' H ' ' C ' ' A' ' 35' ' ' GLN . 26.0 t0 -137.13 4.61 2.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.154 1.782 . . . . 0.0 111.94 177.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.94 -5.0 78.93 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.357 -1.464 . . . . 0.0 112.961 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.3 m -68.94 108.41 3.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.659 1.584 . . . . 0.0 108.971 171.322 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.74 129.82 41.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.007 -1.058 . . . . 0.0 109.957 163.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.3 mtt85 -77.86 172.69 13.08 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.827 1.651 . . . . 0.0 110.71 174.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.42 136.18 33.96 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 162.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.71 157.59 77.94 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.289 1.836 . . . . 0.0 108.486 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.86 123.9 9.72 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.753 1.635 . . . . 0.0 109.739 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -78.51 172.05 14.22 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 164.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -51.65 62.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.095 0.958 . . . . 0.0 111.911 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -67.31 -14.42 62.9 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -68.96 -15.75 63.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.749 1.159 . . . . 0.0 110.884 174.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.94 -30.76 3.65 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 123.343 0.497 . . . . 0.0 112.876 160.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.65 85.13 4.91 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -174.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -73.76 160.81 43.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.999 2.466 . . . . 0.0 112.708 -176.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.467 HG12 ' H ' ' A' ' 70' ' ' GLY . 16.5 mt -85.7 101.05 9.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.479 1.111 . . . . 0.0 108.772 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -121.54 119.16 31.14 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -79.31 164.94 23.68 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 175.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.2 m -149.82 111.71 4.57 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 119.918 -1.739 . . . . 0.0 108.34 167.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.13 147.22 29.17 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 164.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.6 t -165.4 158.22 15.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.8 p -130.88 29.36 4.74 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.567 -0.708 . . . . 0.0 110.089 167.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -53.76 -44.96 70.44 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.01 0.924 . . . . 0.0 112.018 -170.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -14.09 62.77 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.623 0.769 . . . . 0.0 112.623 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.2 2.26 55.81 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 125.497 1.522 . . . . 0.0 112.902 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.0 174.48 6.18 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.492 1.646 . . . . 0.0 108.967 164.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.406 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 26.8 mtp85 -82.21 63.07 6.23 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 125.871 1.668 . . . . 0.0 109.176 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.35 157.99 30.35 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 162.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.31 156.32 43.23 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 149.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 p -126.84 171.72 11.01 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 166.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.97 178.71 44.11 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.339 -1.504 . . . . 0.0 109.339 168.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -111.87 129.73 56.06 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 p -130.21 118.52 21.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.328 1.451 . . . . 0.0 109.3 -176.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.467 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 57.45 -78.83 0.01 OUTLIER Glycine 0 CA--C 1.526 0.778 0 C-N-CA 126.826 2.155 . . . . 0.0 112.052 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.0 OUTLIER -138.67 0.32 2.01 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 170.191 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -117.13 139.11 51.15 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 119.867 1.212 . . . . 0.0 109.587 175.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -70.75 154.93 41.39 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.57 -0.452 . . . . 0.0 109.889 161.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -138.15 164.96 27.85 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.399 1.479 . . . . 0.0 109.393 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -156.0 163.97 39.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.522 1.529 . . . . 0.0 108.469 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.56 -174.76 34.3 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 125.479 1.514 . . . . 0.0 109.331 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 p -84.14 159.57 21.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.587 0.694 . . . . 0.0 112.106 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.406 ' CE1' ' HB3' ' A' ' 63' ' ' ARG . 6.7 p90 -139.75 165.18 27.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 168.468 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.34 153.23 39.43 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.934 1.294 . . . . 0.0 110.78 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.6 mt -126.09 96.69 4.82 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 125.517 1.527 . . . . 0.0 109.62 -168.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -159.81 171.61 19.17 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -171.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 56.52 23.3 7.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.29 1.436 . . . . 0.0 113.948 171.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.46 25.18 68.39 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.048 -1.032 . . . . 0.0 111.54 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -144.87 161.63 38.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.428 1.114 . . . . 0.0 111.422 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.4 tp -78.86 157.19 28.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.8 p -148.96 159.07 44.54 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 120.553 -1.342 . . . . 0.0 108.509 164.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 95.8 m-85 -133.03 165.27 25.14 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.578 1.151 . . . . 0.0 109.211 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -102.72 -156.2 25.37 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 173.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.9 t -56.76 95.04 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.355 1.062 . . . . 0.0 110.234 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mt -84.1 156.56 22.1 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.312 2.245 . . . . 0.0 109.66 167.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -171.14 166.81 39.96 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 165.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -162.62 -174.78 32.94 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 108.305 -1.918 . . . . 0.0 108.305 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.08 173.89 7.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.644 0.735 . . . . 0.0 110.61 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -125.39 73.1 1.29 Allowed 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.276 1.431 . . . . 0.0 107.221 172.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 64.4 mtm -72.71 162.02 30.01 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.862 1.665 . . . . 0.0 109.01 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -106.55 133.43 51.25 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.286 1.034 . . . . 0.0 109.482 174.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 51.0 m -126.97 -9.35 6.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.107 0.963 . . . . 0.0 113.286 166.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.3 ptp 44.69 48.41 8.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.66 1.584 . . . . 0.0 113.123 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.3 p -135.68 156.45 77.49 Favored Pre-proline 0 C--O 1.239 0.537 0 C-N-CA 124.785 1.234 . . . . 0.0 110.372 177.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.95 -25.09 20.12 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.972 2.448 . . . . 0.0 111.85 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.95 -19.36 70.33 Favored Glycine 0 C--N 1.34 0.777 0 CA-C-O 118.439 -1.201 . . . . 0.0 111.561 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.46 -63.5 2.61 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-N 119.492 1.646 . . . . 0.0 110.326 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.42 -3.42 30.42 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -165.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.9 -18.14 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 O-C-N 121.725 -0.609 . . . . 0.0 111.673 167.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -46.53 -48.86 19.25 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.714 1.606 . . . . 0.0 111.302 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -54.34 -42.3 73.85 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.217 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.08 -37.12 61.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.989 0.895 . . . . 0.0 109.194 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.77 -44.83 96.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.192 0.597 . . . . 0.0 110.792 -174.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.72 -40.85 96.53 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.034 0.379 . . . . 0.0 109.983 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -17.66 64.66 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.58 0.752 . . . . 0.0 112.573 177.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.38 2.8 37.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.32 2.248 . . . . 0.0 112.281 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.0 mt -93.5 -26.89 16.97 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.116 1.325 . . . . 0.0 112.514 176.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.16 -11.04 42.3 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.794 1.179 . . . . 0.0 112.552 -178.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -96.98 106.51 18.86 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 168.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -136.02 65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 104.834 -2.284 . . . . 0.0 104.834 172.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.2 -33.76 73.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 116.276 -1.821 . . . . 0.0 109.93 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.594 ' HB2' ' CG1' ' A' ' 131' ' ' VAL . 74.5 mtt-85 -129.03 172.63 11.19 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-N 121.803 2.092 . . . . 0.0 112.981 162.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 m -150.44 150.93 31.99 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.822 1.649 . . . . 0.0 106.734 175.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -136.3 106.47 0.56 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 172.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -86.54 108.67 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 172.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 73.05 3.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 168.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttm -73.71 74.67 1.55 Allowed 'General case' 0 C--N 1.341 0.225 0 CA-C-O 122.717 1.246 . . . . 0.0 107.92 171.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -148.26 112.8 5.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 102.308 -3.219 . . . . 0.0 102.308 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.59 134.99 95.4 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-O 116.907 -1.521 . . . . 0.0 108.0 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -76.09 123.36 9.26 Favored 'Cis proline' 0 N--CA 1.451 -1.018 0 CA-C-N 120.847 1.338 . . . . 0.0 109.978 -2.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -61.72 149.57 39.32 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.297 1.046 . . . . 0.0 111.232 -173.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.54 163.69 31.34 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 126.487 1.915 . . . . 0.0 106.159 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.92 167.49 16.55 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 122.733 1.254 . . . . 0.0 109.098 173.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -148.45 135.4 20.06 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -130.59 153.77 48.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.594 ' CG1' ' HB2' ' A' ' 117' ' ' ARG . 2.6 p -138.45 158.43 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 119.854 -0.739 . . . . 0.0 111.812 175.003 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -103.64 158.22 16.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 122.5 1.143 . . . . 0.0 108.944 175.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -21.12 66.48 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 126.273 1.829 . . . . 0.0 110.841 -166.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -71.81 -35.62 70.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 128.351 2.66 . . . . 0.0 111.065 171.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 126.83 -2.97 7.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 126.485 1.993 . . . . 0.0 113.463 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -68.01 110.46 3.93 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.193 -1.181 . . . . 0.0 108.363 -177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 28.4 m -108.64 106.78 16.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.705 1.602 . . . . 0.0 109.483 -168.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.59 160.41 22.52 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.616 -1.303 . . . . 0.0 109.645 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 61.6 m -137.78 128.86 27.45 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.289 -1.507 . . . . 0.0 109.374 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -118.28 146.28 44.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.604 -175.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -88.19 151.85 22.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 166.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -66.77 135.41 53.93 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 159.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -136.49 113.97 10.92 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.756 -2.683 . . . . 0.0 103.756 158.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.9 p -126.21 12.95 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.321 1.448 . . . . 0.0 111.356 173.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 C-N-CA 123.851 0.86 . . . . 0.0 111.622 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 56.1 mt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -62.34 157.77 43.89 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 121.493 1.462 . . . . 0.0 110.342 173.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -165.28 155.82 13.71 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.136 2.174 . . . . 0.0 106.804 173.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -72.01 163.76 64.28 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 161.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -65.6 -22.46 58.14 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.722 1.614 . . . . 0.0 112.857 175.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -125.2 -4.95 7.32 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 129.754 3.222 . . . . 0.0 111.932 -168.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 m 66.23 -153.9 0.24 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.616 1.567 . . . . 0.0 111.273 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -141.25 12.09 2.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 122.448 1.118 . . . . 0.0 114.012 -171.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 43.83 63.97 1.42 Allowed 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.879 2.472 . . . . 0.0 114.861 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.8 t -117.63 131.57 69.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 122.045 0.926 . . . . 0.0 109.962 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.79 151.43 72.81 Favored Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.686 1.594 . . . . 0.0 110.507 175.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.13 142.63 61.93 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.312 2.008 . . . . 0.0 112.183 -167.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.02 162.12 76.09 Favored Pre-proline 0 C--O 1.239 0.546 0 C-N-CA 127.542 2.337 . . . . 0.0 109.267 -175.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.2 167.33 27.08 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.203 2.602 . . . . 0.0 111.062 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 63.79 64.17 0.79 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.906 1.683 . . . . 0.0 112.159 167.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -127.86 147.85 64.7 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 123.87 0.868 . . . . 0.0 112.423 -167.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.49 -26.41 34.33 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 124.132 3.221 . . . . 0.0 112.09 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.06 -18.7 3.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.95 1.7 . . . . 0.0 112.587 173.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -120.09 18.81 12.36 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.615 1.966 . . . . 0.0 111.016 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.7 m -112.24 -14.2 13.38 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.307 0.958 . . . . 0.0 112.62 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -10.09 59.15 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 120.569 -1.332 . . . . 0.0 113.076 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.41 16.32 20.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.06 0.944 . . . . 0.0 109.214 -175.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.66 14.37 3.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.145 1.778 . . . . 0.0 113.75 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -76.0 -39.05 56.62 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 120.917 1.69 . . . . 0.0 112.033 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.63 -0.91 9.08 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -162.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.2 p -95.32 166.88 11.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.309 1.044 . . . . 0.0 111.642 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.7 m -144.96 149.2 34.8 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.787 1.635 . . . . 0.0 109.515 -169.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -157.93 172.88 17.66 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.781 1.232 . . . . 0.0 112.137 -150.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.8 p -157.02 119.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.0 tp -60.71 127.86 33.75 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.53 -11.87 3.5 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 123.847 0.717 . . . . 0.0 111.527 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.52 151.28 32.43 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 119.607 1.094 . . . . 0.0 110.579 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -138.73 112.49 8.38 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.42 139.95 31.78 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 173.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -70.04 171.17 9.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 160.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.5 84.17 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.203 -0.311 . . . . 0.0 110.664 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 0.9 44.96 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.072 0.949 . . . . 0.0 111.601 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.67 -2.69 49.2 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-O 118.816 -0.991 . . . . 0.0 113.208 168.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 m -61.16 103.81 0.32 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.061 1.344 . . . . 0.0 108.818 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 119.01 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 120.779 -1.201 . . . . 0.0 109.684 169.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -73.24 155.43 39.55 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.092 0.957 . . . . 0.0 109.469 170.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.99 141.35 43.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.421 163.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -138.96 158.59 69.49 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 125.638 1.575 . . . . 0.0 108.24 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.4 109.0 1.92 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.07 1.846 . . . . 0.0 109.706 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.13 173.9 1.77 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.022 0.929 . . . . 0.0 110.5 174.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.11 12.08 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.263 -0.898 . . . . 0.0 110.37 170.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -71.61 -6.56 41.77 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -67.96 -13.45 62.18 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.867 1.212 . . . . 0.0 112.274 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 127.3 -72.66 0.46 Allowed Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.732 1.151 . . . . 0.0 112.131 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.69 85.21 21.24 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 126.101 1.761 . . . . 0.0 109.691 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.01 163.77 37.4 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.346 2.697 . . . . 0.0 112.754 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 16.3 mt -87.16 87.84 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.332 1.053 . . . . 0.0 108.741 177.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.27 130.14 54.18 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -174.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.2 tp -114.39 139.29 49.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.848 1.659 . . . . 0.0 106.942 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 m -125.81 137.73 53.79 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 168.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.5 128.47 56.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 167.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -169.74 177.29 4.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 40.8 p -93.27 47.74 1.28 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 109.647 164.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -61.63 -51.96 66.34 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.069 -1.02 . . . . 0.0 110.03 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -71.38 -25.23 62.27 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.794 -0.566 . . . . 0.0 111.069 177.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.33 0.01 29.6 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.471 1.51 . . . . 0.0 113.848 -167.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -118.14 154.92 31.33 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.907 1.683 . . . . 0.0 108.415 166.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -76.99 78.0 3.54 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.677 1.191 . . . . 0.0 109.809 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -130.45 163.85 26.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.487 1.136 . . . . 0.0 113.939 -173.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.02 100.42 10.01 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 125.89 1.676 . . . . 0.0 106.823 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -108.33 63.69 0.61 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.592 1.187 . . . . 0.0 111.446 -177.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -110.21 169.14 13.37 Favored Glycine 0 N--CA 1.467 0.763 0 C-N-CA 125.146 1.355 . . . . 0.0 111.324 -163.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.429 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.6 t80 -95.03 129.9 41.92 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.6 t -108.16 175.09 5.6 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 163.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.84 -29.77 2.14 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 127.36 2.41 . . . . 0.0 116.639 -156.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.5 t -135.65 -27.03 1.19 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 118.757 1.278 . . . . 0.0 112.716 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.09 137.58 51.33 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.429 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.1 ptt180 -65.67 -174.74 0.23 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.82 -1.536 . . . . 0.0 110.43 170.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -149.91 168.48 23.66 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 124.103 0.961 . . . . 0.0 109.218 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -153.83 153.85 32.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 126.981 2.112 . . . . 0.0 105.965 167.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -164.59 -113.21 0.28 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.498 -1.841 . . . . 0.0 108.498 164.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.82 168.25 20.67 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 126.745 2.018 . . . . 0.0 106.951 157.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -118.43 -179.23 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.719 1.208 . . . . 0.0 108.848 165.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -164.41 116.88 1.32 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.332 0.969 . . . . 0.0 111.256 172.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.04 113.37 12.28 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.133 0.973 . . . . 0.0 109.203 -174.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -148.65 168.53 22.59 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.799 1.24 . . . . 0.0 108.116 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 t0 48.43 23.08 0.54 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.005 2.122 . . . . 0.0 116.064 172.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 67.53 20.49 71.87 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-O 117.136 -1.925 . . . . 0.0 111.976 -172.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -128.11 170.73 12.61 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 128.074 2.55 . . . . 0.0 111.572 -176.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.6 99.58 7.84 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -97.92 157.56 16.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -122.2 175.76 6.21 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.075 1.35 . . . . 0.0 110.379 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.25 -162.75 18.84 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 126.078 1.799 . . . . 0.0 109.483 172.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.2 t -59.01 115.13 2.94 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 163.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.03 155.78 18.39 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.889 1.275 . . . . 0.0 109.127 176.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.87 157.86 12.87 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 163.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.51 91.89 0.1 OUTLIER Glycine 0 CA--C 1.523 0.58 0 CA-C-N 119.187 1.493 . . . . 0.0 114.884 172.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 82.4 p 63.72 175.33 0.17 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 131.508 3.923 . . . . 0.0 112.004 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -137.86 53.4 1.84 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.921 1.689 . . . . 0.0 109.107 -176.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.2 mtm -61.62 170.74 1.79 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.184 0.994 . . . . 0.0 110.425 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.03 128.92 54.82 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.687 1.195 . . . . 0.0 110.414 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 74.3 m -134.28 101.47 5.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 126.446 1.898 . . . . 0.0 106.553 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 22.9 ptp -70.64 44.78 0.08 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.025 1.73 . . . . 0.0 113.22 -177.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.4 p -129.02 161.7 56.51 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 125.855 1.662 . . . . 0.0 107.801 -169.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.06 -47.53 6.36 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.165 1.91 . . . . 0.0 110.085 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.43 -1.76 66.13 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.775 -1.014 . . . . 0.0 112.361 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.95 -42.07 6.1 Favored Glycine 0 C--N 1.336 0.559 0 CA-C-N 118.849 1.324 . . . . 0.0 110.547 175.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.34 -16.34 40.3 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.213 1.006 . . . . 0.0 112.818 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.91 -15.34 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.771 0.829 . . . . 0.0 112.44 173.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -44.75 -47.51 10.78 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 125.604 1.561 . . . . 0.0 110.093 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -53.36 -47.61 61.87 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 119.579 -0.567 . . . . 0.0 111.785 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.97 74.43 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.682 0.741 . . . . 0.0 110.876 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.86 -42.71 90.06 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.7 -0.625 . . . . 0.0 110.216 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.24 -14.3 62.78 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.751 -1.218 . . . . 0.0 112.016 173.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.45 -8.32 45.01 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 169.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.92 -37.31 13.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.4 mt -72.93 -4.83 34.57 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.708 -1.245 . . . . 0.0 112.067 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 76.9 p -78.08 -8.47 58.26 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.674 1.189 . . . . 0.0 111.54 168.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -122.2 71.46 1.01 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.549 1.94 . . . . 0.0 107.633 -174.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.8 mm -107.95 66.2 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -73.8 -42.27 61.21 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 116.624 -2.03 . . . . 0.0 110.334 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -121.72 172.82 7.86 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.009 1.724 . . . . 0.0 110.578 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.414 ' HG1' ' CD2' ' A' ' 130' ' ' LEU . 11.4 t -168.52 172.34 8.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -168.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 174.57 103.13 0.16 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 171.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 67.8 t -88.13 150.92 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 120.506 -1.585 . . . . 0.0 109.641 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.26 93.13 4.34 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.7 ttm -91.58 54.28 2.46 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 123.219 1.485 . . . . 0.0 110.052 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -135.55 126.11 26.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.245 -2.502 . . . . 0.0 104.245 170.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.82 128.6 93.81 Favored Pre-proline 0 N--CA 1.446 -0.659 0 CA-C-O 117.103 -1.427 . . . . 0.0 107.151 171.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.39 114.67 3.2 Favored 'Cis proline' 0 CA--C 1.539 0.749 0 O-C-N 123.531 1.279 . . . . 0.0 114.099 5.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.95 137.55 41.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.811 0.845 . . . . 0.0 110.778 -170.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -146.77 161.89 39.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.202 1.801 . . . . 0.0 108.0 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.33 148.66 27.78 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 171.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -129.42 133.58 47.41 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.311 0.577 . . . . 0.0 109.723 159.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.414 ' CD2' ' HG1' ' A' ' 118' ' ' THR . 90.2 mt -117.65 148.5 41.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.775 1.23 . . . . 0.0 109.638 169.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.8 t -130.95 123.25 53.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -171.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 12.0 mt -71.64 166.93 20.87 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.64 -21.79 41.77 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.135 1.374 . . . . 0.0 111.259 173.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -80.97 -23.65 38.63 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 126.366 1.866 . . . . 0.0 111.72 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.74 -1.57 56.84 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 124.303 0.954 . . . . 0.0 113.448 -170.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.14 146.35 15.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.406 1.482 . . . . 0.0 108.623 170.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.4 m -135.56 102.84 5.24 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.63 1.172 . . . . 0.0 109.15 -163.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.1 mp -93.5 128.05 39.44 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.402 -1.436 . . . . 0.0 109.167 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 32.2 m -107.68 131.92 53.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.533 1.133 . . . . 0.0 108.154 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -127.28 153.79 45.7 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.996 0.919 . . . . 0.0 110.625 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.36 156.31 20.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 117.489 -1.243 . . . . 0.0 108.553 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -85.88 95.35 9.43 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.987 1.721 . . . . 0.0 107.453 162.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -92.0 76.33 5.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 6.4 t -82.24 13.2 3.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 115.736 -2.078 . . . . 0.0 110.897 -172.408 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.8 mp . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.62 -174.14 0.67 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.415 2.743 . . . . 0.0 110.959 168.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.33 167.48 20.96 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 161.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . 0.266 34.4 p80 54.68 164.36 0.05 OUTLIER Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 127.274 2.23 . . . . 0.0 111.801 -168.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -79.97 -45.83 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 0 CA-C-N 120.5 1.214 . . . . 0.0 111.308 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -161.8 -176.59 5.34 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 130.336 3.454 . . . . 0.0 105.837 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -54.79 133.86 47.6 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.704 1.602 . . . . 0.0 109.99 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -142.64 78.08 1.6 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 169.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -162.27 74.17 0.41 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.992 0.917 . . . . 0.0 110.071 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 t -138.22 86.92 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 121.084 -1.01 . . . . 0.0 108.851 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 60.58 165.11 0.1 OUTLIER Pre-proline 0 N--CA 1.471 0.59 0 C-N-CA 126.123 1.769 . . . . 0.0 112.531 -172.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.9 147.88 21.74 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 122.469 2.113 . . . . 0.0 108.874 168.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.39 156.67 62.53 Favored Pre-proline 0 C--O 1.24 0.555 0 C-N-CA 123.573 0.749 . . . . 0.0 109.856 174.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.12 168.21 23.93 Favored 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 123.171 2.581 . . . . 0.0 110.306 178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 66.78 33.35 6.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.162 1.785 . . . . 0.0 112.525 172.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -84.92 144.36 41.67 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 118.231 0.469 . . . . 0.0 112.065 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.97 -23.28 30.03 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.761 2.308 . . . . 0.0 112.03 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.73 -1.73 1.46 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.405 1.882 . . . . 0.0 114.345 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.02 3.99 14.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.48 1.512 . . . . 0.0 112.004 -178.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.475 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.3 t -74.86 -12.24 60.33 Favored 'General case' 0 CA--C 1.556 1.183 0 O-C-N 121.447 -0.783 . . . . 0.0 111.119 -175.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -8.37 34.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 118.992 -2.318 . . . . 0.0 112.641 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.2 mt -105.9 21.08 17.9 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.337 1.055 . . . . 0.0 112.391 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.475 ' CD2' ' HA ' ' A' ' 20' ' ' THR . 3.1 mm? -110.08 62.5 0.6 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.264 1.826 . . . . 0.0 109.169 -175.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 p-10 -137.29 -41.03 0.57 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 123.689 0.796 . . . . 0.0 112.129 -163.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -136.41 16.76 3.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.354 1.073 . . . . 0.0 110.897 -177.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.7 170.24 8.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.191 2.997 . . . . 0.0 109.114 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.3 m -152.18 148.27 27.41 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 119.295 -2.128 . . . . 0.0 110.096 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 28.0 m95 -148.78 175.3 11.35 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.067 1.347 . . . . 0.0 110.221 -162.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.9 t -146.29 127.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.82 133.1 47.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 t -133.56 -9.92 2.81 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.41 140.78 18.69 Favored 'General case' 0 C--N 1.339 0.143 0 O-C-N 120.629 -1.295 . . . . 0.0 109.351 -175.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -135.28 98.76 4.05 Favored 'General case' 0 C--N 1.334 -0.106 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.82 136.61 34.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 120.447 -1.408 . . . . 0.0 107.312 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -66.97 163.83 18.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 157.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.57 84.47 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.247 0.546 . . . . 0.0 111.033 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -12.63 59.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 122.776 0.43 . . . . 0.0 110.427 -175.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 119.46 -4.59 13.38 Favored Glycine 0 C--N 1.34 0.798 0 CA-C-O 118.317 -1.268 . . . . 0.0 114.276 169.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -73.22 107.75 5.72 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.894 1.847 . . . . 0.0 108.84 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.51 110.3 1.64 Allowed 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.631 0.772 . . . . 0.0 109.89 166.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -62.0 154.42 26.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.498 1.519 . . . . 0.0 110.308 172.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.66 132.61 47.82 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 m -138.87 156.35 72.73 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 124.402 1.081 . . . . 0.0 109.876 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.15 108.69 2.21 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.45 2.1 . . . . 0.0 110.249 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 168.78 12.96 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.091 0.956 . . . . 0.0 111.033 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.26 -7.95 46.33 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.369 1.468 . . . . 0.0 112.836 170.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -118.51 9.92 12.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.304 2.242 . . . . 0.0 111.078 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -98.63 -10.35 23.44 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.298 -0.876 . . . . 0.0 112.346 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.59 -45.0 1.19 Allowed Glycine 0 C--N 1.335 0.509 0 C-N-CA 123.847 0.736 . . . . 0.0 114.312 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.87 79.53 27.33 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 127.032 2.133 . . . . 0.0 109.8 -170.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -66.22 158.41 54.97 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 123.135 2.557 . . . . 0.0 111.231 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.1 mt -90.22 113.54 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 C-N-CA 124.341 1.056 . . . . 0.0 108.229 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.9 p -119.06 140.72 49.58 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 -171.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.1 tp -125.5 140.48 52.73 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.13 1.372 . . . . 0.0 108.791 -177.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 20.7 m -134.8 129.35 34.41 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.707 1.603 . . . . 0.0 107.208 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -118.75 122.95 43.66 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 178.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -168.63 -153.12 0.12 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.8 p -122.46 46.86 2.04 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.266 1.026 . . . . 0.0 112.545 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.22 -46.85 88.33 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.571 -1.331 . . . . 0.0 111.851 -173.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -77.89 1.39 20.67 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.07 -1.644 . . . . 0.0 112.342 173.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.78 -9.86 74.66 Favored Glycine 0 CA--C 1.526 0.736 0 O-C-N 120.079 -1.638 . . . . 0.0 113.119 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -104.6 160.38 14.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 119.47 1.635 . . . . 0.0 108.962 164.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -64.33 91.27 0.07 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.839 0.856 . . . . 0.0 109.604 171.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -133.74 155.28 50.04 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.603 0.716 . . . . 0.0 110.021 -178.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.79 146.78 26.62 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.62 151.95 45.81 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 154.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.45 177.92 48.06 Favored Glycine 0 N--CA 1.445 -0.763 0 O-C-N 121.222 -0.923 . . . . 0.0 112.227 -174.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -125.13 105.57 9.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.69 1.196 . . . . 0.0 107.994 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -85.03 -1.35 56.72 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 125.083 1.353 . . . . 0.0 113.915 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 149.48 -74.71 0.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 109.374 -1.49 . . . . 0.0 109.374 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 18.0 t -151.05 14.78 0.72 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 1.157 . . . . 0.0 113.386 177.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.08 -6.01 10.47 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.081 -1.637 . . . . 0.0 112.327 172.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 52.65 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.515 1.526 . . . . 0.0 111.441 -162.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -151.72 153.28 34.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.558 167.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -145.41 161.25 40.13 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.692 1.997 . . . . 0.0 107.19 170.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.46 163.43 11.6 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 171.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 20.3 m -69.59 163.91 24.45 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.935 0.894 . . . . 0.0 111.329 -170.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -137.93 171.94 13.68 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.53 0.732 . . . . 0.0 111.598 172.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.06 150.38 31.65 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.881 1.672 . . . . 0.0 108.024 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 70.1 mt -117.63 117.36 29.17 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -164.44 168.4 18.5 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.753 1.221 . . . . 0.0 109.285 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.0 t0 48.19 23.4 0.53 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.04 77.88 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 120.085 -1.634 . . . . 0.0 113.148 -175.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -141.37 140.9 33.8 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.065 1.933 . . . . 0.0 112.164 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.8 tp -82.88 105.15 13.65 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.852 1.661 . . . . 0.0 108.697 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.9 m -106.88 159.05 16.55 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.789 0.804 . . . . 0.0 109.534 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 73.3 m-85 -115.59 -165.92 1.08 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.69 1.196 . . . . 0.0 110.435 -167.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.37 -87.77 1.7 Allowed Glycine 0 C--N 1.334 0.433 0 O-C-N 120.717 -1.24 . . . . 0.0 110.085 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.8 m -154.69 69.22 0.74 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.526 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -61.92 164.2 6.76 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 120.923 -1.111 . . . . 0.0 112.494 -173.219 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -177.3 -179.98 47.83 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 169.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.13 -158.25 7.57 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.505 1.05 . . . . 0.0 111.642 -171.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 58.7 p -88.32 178.98 6.43 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 166.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -128.28 59.16 1.52 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.306 1.412 . . . . 0.0 110.724 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.9 mtm -59.19 165.06 2.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.493 161.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.93 153.33 24.66 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -134.71 159.64 40.65 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 123.629 0.771 . . . . 0.0 109.741 169.456 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -111.61 19.54 18.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 124.818 1.247 . . . . 0.0 110.772 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.4 p -96.49 165.09 16.8 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.125 1.77 . . . . 0.0 108.133 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.77 -42.06 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.261 1.974 . . . . 0.0 109.572 165.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.47 7.31 48.25 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-O 118.319 -1.267 . . . . 0.0 112.927 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.82 -55.84 2.08 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 108.136 -1.986 . . . . 0.0 108.136 170.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -60.47 -27.03 67.23 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.871 0.868 . . . . 0.0 112.487 -174.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -63.63 -17.91 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.581 0.752 . . . . 0.0 112.3 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.04 -40.91 64.27 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 119.364 0.984 . . . . 0.0 110.404 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.57 -28.18 72.07 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.088 -0.84 . . . . 0.0 111.973 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -80.42 -45.41 17.69 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.355 1.077 . . . . 0.0 110.031 171.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.14 -46.6 86.47 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 111.115 -171.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.54 -47.46 69.97 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 118.422 0.556 . . . . 0.0 109.549 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.57 -32.49 74.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.044 0.538 . . . . 0.0 111.735 -177.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.21 -26.49 68.15 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.303 0.641 . . . . 0.0 111.357 174.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 77.4 mt -69.02 -12.11 61.39 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.997 0.817 . . . . 0.0 112.25 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.3 p -91.3 -4.57 55.74 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.327 0.967 . . . . 0.0 111.806 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -117.82 71.52 0.82 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.9 mm -107.62 83.13 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 106.201 -1.778 . . . . 0.0 106.201 172.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -95.91 -28.87 14.48 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 119.365 -0.934 . . . . 0.0 112.257 166.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -130.16 166.54 20.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 122.493 1.14 . . . . 0.0 110.303 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.9 m -162.81 170.02 18.94 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 -177.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.44 143.04 10.18 Favored Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 105.319 -3.113 . . . . 0.0 105.319 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.6 t -129.47 128.52 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 174.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.01 88.82 2.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 -174.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 50.39 0.61 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.854 1.788 . . . . 0.0 111.659 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.24 128.39 48.22 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.219 2.607 . . . . 0.0 104.358 170.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.22 136.3 80.97 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-O 117.204 -1.379 . . . . 0.0 107.684 147.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -72.67 121.89 7.01 Favored 'Cis proline' 0 N--CA 1.456 -0.703 0 CA-C-N 120.341 1.157 . . . . 0.0 110.825 -8.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.68 138.9 41.63 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.622 0.725 . . . . 0.0 110.884 -171.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -146.27 153.76 40.94 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 171.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 44.8 ttp -116.36 145.31 43.31 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.491 1.516 . . . . 0.0 107.675 176.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.404 HE21 ' CG2' ' A' ' 137' ' ' THR . 27.2 mt-30 -133.65 102.81 5.62 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.384 0.993 . . . . 0.0 110.868 178.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 73.3 mt -80.62 148.88 30.08 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 66.0 t -131.72 128.47 60.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 11.2 mt -81.49 156.49 25.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.75 -36.19 35.35 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.731 1.612 . . . . 0.0 112.454 177.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.75 -6.26 58.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.075 1.35 . . . . 0.0 111.27 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.96 -4.22 14.18 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.93 1.729 . . . . 0.0 114.897 157.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.28 156.83 7.02 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 109.845 -178.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' THR . . . . . 0.404 ' CG2' HE21 ' A' ' 129' ' ' GLN . 27.2 m -140.0 97.76 3.31 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.299 -0.876 . . . . 0.0 109.548 -172.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.36 142.58 30.93 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 35.7 m -127.85 129.6 47.2 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 125.82 1.648 . . . . 0.0 107.676 -173.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.42 121.66 27.8 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.619 1.168 . . . . 0.0 108.714 -167.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.93 144.24 41.18 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -70.57 129.43 39.18 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 172.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 47.8 t -136.13 83.94 2.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.52 19.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.202 1.401 . . . . 0.0 112.425 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 CA-C-O 114.56 -2.638 . . . . 0.0 110.441 -167.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.4 mm . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -97.12 77.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.995 2.463 . . . . 0.0 111.245 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.45 77.67 0.22 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.423 1.489 . . . . 0.0 111.019 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 65.36 165.85 0.12 Allowed Pre-proline 0 CA--C 1.548 0.893 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.796 -170.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.65 -4.98 15.11 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.679 2.253 . . . . 0.0 115.383 -166.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.82 69.44 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.449 2.3 . . . . 0.0 111.632 -166.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.2 m -63.78 14.08 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.355 2.662 . . . . 0.0 115.121 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -108.48 72.84 0.85 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.168 1.387 . . . . 0.0 108.203 -169.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 57.19 0.99 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.879 -1.055 . . . . 0.0 111.069 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.1 t -130.55 136.13 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 174.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.46 153.5 72.44 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 123.579 0.752 . . . . 0.0 110.697 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.99 176.94 8.38 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 124.162 3.242 . . . . 0.0 111.067 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.42 151.47 69.16 Favored Pre-proline 0 C--O 1.241 0.639 0 C-N-CA 123.36 0.664 . . . . 0.0 110.115 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.5 163.47 26.97 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.958 3.106 . . . . 0.0 111.624 174.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -143.48 46.49 1.5 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.508 2.723 . . . . 0.0 106.874 -175.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.9 t30 42.03 75.41 0.62 Allowed Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 127.748 2.419 . . . . 0.0 114.25 164.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -60.3 -17.72 48.44 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.178 2.585 . . . . 0.0 114.856 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.18 0.4 9.83 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.742 -1.224 . . . . 0.0 113.631 169.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.58 -26.19 54.8 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.998 1.719 . . . . 0.0 112.184 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.8 m -62.14 -30.03 70.76 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.324 1.42 . . . . 0.0 111.669 -160.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -20.14 63.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.039 0.936 . . . . 0.0 113.088 177.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.47 -7.58 59.6 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.248 1.019 . . . . 0.0 110.797 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -77.7 5.02 10.14 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.684 -0.635 . . . . 0.0 110.49 173.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -73.1 -20.68 60.9 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 127.433 2.293 . . . . 0.0 112.54 171.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.28 51.38 0.36 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -163.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -153.09 139.13 18.21 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.128 -1.608 . . . . 0.0 109.673 177.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 m -84.5 -64.48 1.15 Allowed 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 -166.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 15.8 m95 75.5 160.94 0.23 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.948 3.299 . . . . 0.0 115.369 179.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.0 p -150.19 115.54 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.033 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -179.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.81 134.93 53.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.044 0.84 . . . . 0.0 109.456 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.9 t -144.06 -2.23 0.92 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 174.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -155.12 150.86 27.6 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.462 -1.399 . . . . 0.0 111.455 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -139.2 132.12 29.36 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.758 2.023 . . . . 0.0 105.988 -179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.28 135.21 53.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.969 2.107 . . . . 0.0 107.36 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -78.13 170.2 17.01 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.221 0.534 . . . . 0.0 109.583 169.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.06 -15.71 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.07 3.82 44.58 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.756 1.223 . . . . 0.0 110.915 173.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.82 -7.72 81.22 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 124.559 1.076 . . . . 0.0 112.784 175.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 44.5 m -60.94 105.15 0.43 Allowed 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 126.969 2.108 . . . . 0.0 109.883 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.11 111.82 6.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.619 0.767 . . . . 0.0 109.658 170.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.07 155.02 39.77 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.656 0.783 . . . . 0.0 110.751 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.25 141.36 48.94 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 160.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.9 m -143.05 165.9 23.43 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 128.394 2.677 . . . . 0.0 105.63 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -64.42 124.66 13.68 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 CA-C-N 121.478 1.564 . . . . 0.0 108.516 168.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.77 153.86 42.38 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 123.843 0.857 . . . . 0.0 109.96 170.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.78 98.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.961 -0.462 . . . . 0.0 110.751 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.48 2.26 12.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.215 1.006 . . . . 0.0 112.052 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -84.67 -19.09 33.39 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.507 -0.759 . . . . 0.0 111.166 168.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 150.73 -84.14 0.16 Allowed Glycine 0 C--N 1.339 0.709 0 CA-C-N 119.589 1.086 . . . . 0.0 111.703 173.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -120.25 85.23 35.95 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 124.289 1.035 . . . . 0.0 109.945 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.12 175.46 3.19 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.684 2.922 . . . . 0.0 113.178 -178.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.43 HG12 ' H ' ' A' ' 70' ' ' GLY . 20.5 mt -85.08 76.82 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 124.928 1.291 . . . . 0.0 109.32 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.11 127.68 35.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 104.174 -2.528 . . . . 0.0 104.174 -176.319 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.2 tp -86.59 156.91 19.85 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 172.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -142.3 122.69 13.99 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 168.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 mt -117.89 114.3 23.02 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -164.58 -169.06 1.65 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.038 1.735 . . . . 0.0 108.271 177.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.9 p -130.77 27.7 4.92 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.883 -1.136 . . . . 0.0 114.023 -164.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 t -55.67 -49.02 74.03 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.157 -0.965 . . . . 0.0 112.28 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.3 t -70.5 5.71 1.7 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.773 1.17 . . . . 0.0 112.612 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.52 -5.6 73.0 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 119.765 -1.835 . . . . 0.0 113.692 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -115.49 152.51 32.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 118.976 1.388 . . . . 0.0 111.583 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 ptp85 -70.88 74.35 0.61 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.906 1.682 . . . . 0.0 110.385 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -130.51 147.61 52.22 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.199 -0.938 . . . . 0.0 110.093 -178.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.36 155.39 24.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -158.78 98.73 1.51 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 109.127 159.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -101.25 -158.76 27.16 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.414 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 15.4 t80 -126.02 122.41 35.8 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 104.558 -2.386 . . . . 0.0 104.558 174.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.466 ' CB ' ' CZ ' ' A' ' 108' ' ' TYR . 18.7 t -117.15 100.22 7.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.886 2.13 . . . . 0.0 111.315 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . 0.43 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 76.59 -71.99 2.03 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 125.498 1.523 . . . . 0.0 111.855 172.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.8 t -135.62 -2.1 2.46 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.094 1.358 . . . . 0.0 111.353 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.486 ' ND2' ' H ' ' A' ' 95' ' ' MET . 5.3 m120 -136.49 108.74 7.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -162.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -62.16 159.57 14.48 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 122.466 1.127 . . . . 0.0 110.954 162.438 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -139.64 174.25 10.7 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 112.117 -2.311 . . . . 0.0 108.324 -168.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -159.96 165.6 31.71 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.927 0.891 . . . . 0.0 109.862 173.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 151.96 165.22 12.9 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 124.772 1.177 . . . . 0.0 110.794 164.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 60.6 p -74.12 168.02 20.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.737 0.769 . . . . 0.0 110.778 -163.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -135.51 176.47 8.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.822 0.849 . . . . 0.0 112.304 170.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.48 149.54 30.12 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.326 1.85 . . . . 0.0 107.726 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 74.5 mt -128.42 78.67 1.86 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.775 1.23 . . . . 0.0 108.419 -163.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -147.1 168.16 22.29 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.445 1.098 . . . . 0.0 109.512 -169.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.5 t70 56.81 25.07 9.89 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.043 0.937 . . . . 0.0 112.513 169.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.32 -11.39 37.83 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.084 1.802 . . . . 0.0 113.662 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -121.21 137.25 54.76 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.841 2.321 . . . . 0.0 113.311 -163.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 38.4 tp -67.81 107.21 2.53 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 167.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.5 m -100.84 164.73 11.7 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.319 1.048 . . . . 0.0 109.211 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -137.21 147.72 46.02 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.703 0.801 . . . . 0.0 110.909 -175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.01 -154.31 27.27 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.269 1.89 . . . . 0.0 110.611 171.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.5 m -64.18 98.41 0.22 Allowed 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.3 0.64 . . . . 0.0 109.733 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -84.96 166.24 16.93 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 170.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 167.83 -171.81 42.4 Favored Glycine 0 CA--C 1.53 0.987 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.46 -150.9 8.22 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 118.93 1.365 . . . . 0.0 112.854 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.2 p -85.11 171.15 12.25 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.437 1.495 . . . . 0.0 112.051 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.6 mtt180 -130.04 62.03 1.57 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.572 1.149 . . . . 0.0 110.87 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.486 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 2.7 mtt -82.04 149.39 28.11 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.171 -0.955 . . . . 0.0 108.443 175.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -90.44 140.74 29.44 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.619 0.768 . . . . 0.0 110.855 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -117.55 -21.95 8.34 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 172.218 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 68.25 19.23 9.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.753 1.221 . . . . 0.0 112.213 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 81.2 p -120.59 155.5 56.73 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 126.44 1.896 . . . . 0.0 110.784 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.2 -28.57 47.99 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.543 2.162 . . . . 0.0 111.815 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.8 -8.41 87.77 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-O 117.994 -1.448 . . . . 0.0 113.126 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.63 -47.74 9.75 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-N 119.74 1.77 . . . . 0.0 109.315 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -70.21 -24.05 63.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.072 0.936 . . . . 0.0 113.367 -167.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.9 tt -64.49 -9.1 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 O-C-N 121.679 -0.638 . . . . 0.0 112.276 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.407 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 8.3 tm-20 -61.47 -16.09 43.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.366 2.266 . . . . 0.0 111.848 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -83.71 -29.05 33.34 Favored Glycine 0 CA--C 1.525 0.672 0 O-C-N 120.079 -1.638 . . . . 0.0 112.947 170.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.65 -47.09 20.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.713 1.256 . . . . 0.0 109.621 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.466 ' CZ ' ' CB ' ' A' ' 69' ' ' SER . 0.3 OUTLIER -61.09 -37.45 82.79 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 122.965 0.506 . . . . 0.0 111.524 -162.149 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.435 HD12 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -69.96 -47.28 62.93 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.571 1.948 . . . . 0.0 109.386 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -14.15 56.22 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.402 1.081 . . . . 0.0 113.062 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -94.97 -28.97 14.88 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.057 1.343 . . . . 0.0 111.502 174.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.6 mt -71.59 -8.93 57.11 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.683 -1.261 . . . . 0.0 113.194 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 9.9 p -80.56 -9.94 59.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.17 0.895 . . . . 0.0 112.338 171.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -122.35 71.05 1.0 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 125.208 1.403 . . . . 0.0 109.759 -168.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.4 mm -103.61 54.16 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -28.42 69.89 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.803 -0.56 . . . . 0.0 111.048 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -141.14 166.23 25.34 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.665 1.586 . . . . 0.0 110.266 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.2 t -160.05 161.93 34.06 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.22 83.61 0.14 Allowed Glycine 0 CA--C 1.524 0.651 0 CA-C-O 119.799 -0.445 . . . . 0.0 113.286 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.5 p -91.14 97.19 6.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.684 1.742 . . . . 0.0 111.83 170.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.72 98.63 9.78 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.493 1.117 . . . . 0.0 108.512 171.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.0 mtt -86.32 30.57 0.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.411 1.484 . . . . 0.0 114.415 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.02 89.85 3.21 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 120.292 -1.505 . . . . 0.0 110.7 -166.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -36.53 120.56 0.76 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 126.441 1.897 . . . . 0.0 112.652 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.06 126.68 9.24 Favored 'Cis proline' 0 N--CA 1.459 -0.554 0 CA-C-N 119.908 1.003 . . . . 0.0 111.724 1.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -83.84 145.04 28.87 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -140.32 179.61 6.55 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 165.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -132.93 147.65 52.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 162.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -119.04 151.12 38.81 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 126.266 1.826 . . . . 0.0 108.0 170.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.5 mt -114.44 153.44 29.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 113.541 -1.663 . . . . 0.0 106.724 155.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 41.9 t -140.49 118.98 10.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 173.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 39.5 mt -76.18 173.65 11.07 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.288 1.042 . . . . 0.0 110.933 178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -57.56 -17.62 15.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.267 1.427 . . . . 0.0 113.355 158.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -78.5 -2.44 38.66 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.38 16.96 78.75 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 124.074 0.845 . . . . 0.0 112.457 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -173.24 0.44 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.831 0.852 . . . . 0.0 112.237 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 31.4 m -148.79 125.66 11.23 Favored 'General case' 0 N--CA 1.461 0.125 0 O-C-N 119.165 -2.21 . . . . 0.0 108.189 159.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -105.48 161.2 14.55 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.094 0.958 . . . . 0.0 108.485 170.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 42.1 m -143.08 123.33 13.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.297 0.639 . . . . 0.0 110.515 -168.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -125.88 143.6 51.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.327 1.851 . . . . 0.0 110.981 -172.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.45 164.9 22.68 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 119.612 1.096 . . . . 0.0 108.813 175.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -87.62 97.72 11.02 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 156.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.7 t -109.62 52.87 0.71 Allowed 'General case' 0 C--O 1.219 -0.516 0 O-C-N 120.955 -1.09 . . . . 0.0 108.552 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.4 t -76.88 8.02 4.18 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.372 -0.83 . . . . 0.0 111.987 176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 124.062 0.945 . . . . 0.0 109.732 -173.824 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 22.9 mm . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -68.33 -179.89 2.55 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.496 2.13 . . . . 0.0 110.225 169.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -76.04 156.83 33.61 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 162.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -131.13 165.21 36.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 C-N-CA 126.843 2.057 . . . . 0.0 105.727 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.54 -22.76 28.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 121.27 1.314 . . . . 0.0 111.866 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.5 t0 56.81 162.57 0.02 OUTLIER 'General case' 0 C--O 1.234 0.259 0 C-N-CA 128.828 2.851 . . . . 0.0 112.125 -156.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.425 ' C ' ' H ' ' A' ' 9' ' ' ALA . 23.5 m -166.28 173.02 10.49 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.23 1.812 . . . . 0.0 108.695 177.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -74.39 18.31 0.16 Allowed 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.431 -0.793 . . . . 0.0 112.221 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.425 ' H ' ' C ' ' A' ' 7' ' ' SER . . . -81.07 38.84 0.48 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.374 1.469 . . . . 0.0 112.572 -169.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -144.99 117.87 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.153 1.781 . . . . 0.0 106.884 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.52 157.99 75.78 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.65 168.71 19.24 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 122.781 2.321 . . . . 0.0 112.062 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.03 160.11 41.39 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.535 1.534 . . . . 0.0 111.978 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -74.65 -174.58 1.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 124.653 3.568 . . . . 0.0 111.516 -176.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 49.65 74.5 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.538 1.935 . . . . 0.0 113.263 167.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -131.16 144.78 54.92 Favored Pre-proline 0 N--CA 1.469 0.51 0 C-N-CA 123.841 0.856 . . . . 0.0 111.202 -166.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.15 -12.0 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.175 2.583 . . . . 0.0 112.257 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.95 -2.1 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.788 -1.195 . . . . 0.0 113.002 165.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.6 21.93 10.74 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.909 2.083 . . . . 0.0 110.818 172.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.4 m -84.8 -62.55 1.52 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.945 1.248 . . . . 0.0 113.949 169.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . 0.504 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -61.43 -26.09 67.65 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.081 1.764 . . . . 0.0 115.237 -160.27 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.465 ' C ' ' H ' ' A' ' 24' ' ' ASP . 5.5 mt -75.73 -6.11 48.96 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.838 1.655 . . . . 0.0 111.168 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.14 17.31 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.689 1.196 . . . . 0.0 111.963 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -89.03 -11.25 44.71 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.007 1.723 . . . . 0.0 112.054 171.645 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -128.11 -12.04 5.23 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.0 p -82.62 170.25 15.36 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.593 -0.692 . . . . 0.0 111.839 -172.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -144.64 148.95 34.91 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -153.14 165.63 35.05 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 125.209 1.404 . . . . 0.0 108.98 -164.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 74.3 t -143.04 120.66 6.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.75 132.77 53.34 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -139.21 -14.12 1.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.078 0.769 . . . . 0.0 113.078 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.43 43.82 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.916 1.234 . . . . 0.0 109.337 166.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -142.06 93.96 2.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 133.96 45.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 171.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -65.02 164.41 12.85 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 156.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.1 65.57 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.937 0.495 . . . . 0.0 111.992 -172.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.21 -18.43 23.47 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.327 1.051 . . . . 0.0 112.529 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 127.37 -6.05 7.16 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 115.082 0.793 . . . . 0.0 115.082 176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -69.27 103.62 2.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 119.362 1.581 . . . . 0.0 108.72 176.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 122.75 18.39 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 121.196 -0.94 . . . . 0.0 108.977 170.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.8 mtt180 -75.89 153.3 36.82 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.597 1.559 . . . . 0.0 110.312 174.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.56 125.5 26.72 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 123.775 0.83 . . . . 0.0 109.97 168.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.0 m -131.29 155.31 81.68 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 126.139 1.776 . . . . 0.0 108.028 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.49 120.88 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.568 2.178 . . . . 0.0 110.802 -178.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 168.03 8.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.346 -0.846 . . . . 0.0 111.913 164.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.28 -32.04 64.19 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 121.346 -0.846 . . . . 0.0 111.757 167.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.39 -13.3 52.61 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 121.63 -0.669 . . . . 0.0 112.517 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -75.49 -17.7 60.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.95 -22.72 5.68 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 123.735 0.683 . . . . 0.0 114.131 163.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.64 85.47 3.68 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.397 1.099 . . . . 0.0 111.087 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.84 154.26 71.38 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.93 1.753 . . . . 0.0 111.578 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.6 mt -87.48 103.22 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 127.382 2.273 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 p -123.88 135.68 53.87 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.336 -164.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -128.88 135.52 49.18 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.452 1.901 . . . . 0.0 109.432 -167.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.0 m -146.35 115.27 6.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.41 HD13 ' CE2' ' A' ' 78' ' ' TYR . 2.7 mm? -104.51 112.21 25.18 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -174.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.6 t -161.02 -174.5 4.41 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.3 p -93.75 35.42 1.14 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.969 0.908 . . . . 0.0 112.178 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.7 t -50.49 -55.27 16.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.856 1.207 . . . . 0.0 114.191 -161.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -94.0 8.8 40.06 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.572 1.078 . . . . 0.0 110.669 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.48 -24.51 5.25 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.199 1.381 . . . . 0.0 114.615 165.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' H ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -121.4 166.37 14.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 128.111 2.565 . . . . 0.0 109.288 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.417 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 3.9 ptp85 -66.94 97.01 0.46 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.71 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.5 170.86 15.0 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 123.839 1.78 . . . . 0.0 113.002 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.91 75.18 0.94 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 112.036 -2.347 . . . . 0.0 107.131 -175.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.91 86.61 4.79 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -128.68 179.49 16.58 Favored Glycine 0 CA--C 1.507 -0.415 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 -165.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -118.51 140.03 50.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.855 0.836 . . . . 0.0 109.061 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -144.99 135.1 23.93 Favored 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 128.49 2.716 . . . . 0.0 104.757 -171.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 44.14 -91.83 0.01 OUTLIER Glycine 0 CA--C 1.524 0.608 0 C-N-CA 127.514 2.483 . . . . 0.0 112.465 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.4 t -152.63 33.1 0.5 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.721 1.248 . . . . 0.0 111.572 162.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -125.03 -7.17 7.19 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 120.547 -1.346 . . . . 0.0 114.012 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 44.89 177.52 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 129.114 2.966 . . . . 0.0 113.106 -175.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -154.95 159.21 40.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.117 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.21 160.0 23.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.746 1.618 . . . . 0.0 108.61 173.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 170.82 -86.06 0.08 OUTLIER Glycine 0 CA--C 1.527 0.822 0 CA-C-O 119.479 -0.623 . . . . 0.0 112.274 163.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 p -164.56 162.21 21.56 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.585 1.954 . . . . 0.0 110.099 -178.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 37.7 p90 -143.99 171.71 13.87 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.099 0.96 . . . . 0.0 110.876 165.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -149.48 142.15 24.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 126.161 1.784 . . . . 0.0 108.617 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -102.09 93.36 5.2 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 122.179 0.99 . . . . 0.0 109.762 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -124.16 176.75 6.2 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.653 1.981 . . . . 0.0 108.695 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 52.81 14.11 0.4 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.41 2.284 . . . . 0.0 116.078 174.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 56.38 35.77 67.18 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 120.082 -1.636 . . . . 0.0 111.856 -163.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -142.66 177.31 8.39 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 127.015 2.126 . . . . 0.0 112.353 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -87.13 139.9 30.1 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.1 p -131.91 148.38 52.53 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.448 1.476 . . . . 0.0 109.948 161.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -112.88 157.66 21.15 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.286 1.034 . . . . 0.0 109.79 178.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.95 -153.43 25.72 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.646 1.117 . . . . 0.0 112.047 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.37 86.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.442 1.897 . . . . 0.0 108.694 170.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 67.2 mt -79.52 173.44 12.58 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 120.995 -1.066 . . . . 0.0 111.605 -175.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 159.01 179.42 33.84 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 170.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.09 -109.77 0.43 Allowed Glycine 0 C--N 1.333 0.384 0 C-N-CA 125.166 1.365 . . . . 0.0 111.01 -171.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -155.61 159.49 39.67 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.796 1.638 . . . . 0.0 107.958 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -103.14 38.37 1.77 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.591 1.556 . . . . 0.0 110.371 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mtm -59.85 162.54 5.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.164 0.986 . . . . 0.0 109.549 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -107.17 144.14 34.35 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -125.49 -15.85 6.0 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 176.568 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.259 18.1 ptp 46.39 44.57 12.94 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.186 1.794 . . . . 0.0 112.419 -174.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 80.0 p -132.55 157.43 78.34 Favored Pre-proline 0 C--O 1.239 0.527 0 C-N-CA 125.417 1.487 . . . . 0.0 109.58 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.79 -27.69 21.25 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 121.533 1.488 . . . . 0.0 112.045 173.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -63.9 -36.1 92.85 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 169.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.08 -35.28 91.23 Favored Glycine 0 C--N 1.335 0.519 0 CA-C-N 120.096 1.948 . . . . 0.0 113.304 -170.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -86.12 -13.56 46.81 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.036 0.918 . . . . 0.0 112.85 -175.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.7 tt -68.31 -9.9 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 118.918 0.781 . . . . 0.0 111.22 -178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -44.74 -51.3 9.46 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.824 0.85 . . . . 0.0 110.899 166.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.7 -39.01 92.99 Favored Glycine 0 C--N 1.337 0.639 0 CA-C-O 119.089 -0.84 . . . . 0.0 111.381 -173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.41 -45.83 65.16 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.475 0.71 . . . . 0.0 110.256 175.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -63.64 -45.12 91.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.781 0.832 . . . . 0.0 110.91 -171.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.0 mt -62.72 -36.37 82.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.197 0.908 . . . . 0.0 109.827 173.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -17.78 64.76 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.079 1.352 . . . . 0.0 113.143 175.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.03 -33.06 12.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.776 1.23 . . . . 0.0 110.658 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.85 -21.44 66.44 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.546 1.538 . . . . 0.0 112.084 176.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -81.64 -9.42 59.67 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.478 1.511 . . . . 0.0 112.842 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -133.46 65.66 1.58 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -175.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.0 mm -89.15 69.98 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 103.413 -2.81 . . . . 0.0 103.413 163.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -73.27 -44.94 58.4 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 118.785 -1.166 . . . . 0.0 109.044 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -122.07 168.19 12.25 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.222 1.809 . . . . 0.0 109.767 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.2 t -163.67 170.9 16.41 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.853 -1.154 . . . . 0.0 108.482 -167.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -177.65 104.25 0.19 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.232 -1.147 . . . . 0.0 110.232 175.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.3 p -113.13 142.87 24.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 O-C-N 121.144 -1.209 . . . . 0.0 109.598 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -120.75 78.91 1.43 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 125.888 1.675 . . . . 0.0 106.745 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 48.1 ttm -76.09 62.85 1.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.381 171.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -147.23 104.97 3.71 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -45.37 125.51 5.91 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.988 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.66 124.0 8.77 Favored 'Cis proline' 0 N--CA 1.459 -0.553 0 CA-C-N 119.95 1.018 . . . . 0.0 111.629 3.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -79.0 134.6 36.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -141.43 162.39 35.59 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 163.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -127.06 147.52 50.15 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 126.133 1.773 . . . . 0.0 106.247 172.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -146.18 128.06 15.41 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -171.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -114.3 151.36 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.47 -0.769 . . . . 0.0 109.122 -178.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.42 117.6 47.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.3 mp -68.73 169.21 11.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.783 0.801 . . . . 0.0 110.865 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -53.57 -33.26 54.13 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.584 1.554 . . . . 0.0 112.058 172.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -84.19 -27.38 28.07 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.478 -0.764 . . . . 0.0 112.148 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.37 -5.17 10.17 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 117.856 -1.524 . . . . 0.0 115.179 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -52.33 127.46 22.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.56 1.68 . . . . 0.0 108.771 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.2 m -105.5 98.14 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.918 1.287 . . . . 0.0 109.17 -170.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.3 mp -83.21 142.62 31.03 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.496 -1.377 . . . . 0.0 108.608 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 54.4 m -123.73 132.04 53.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.492 1.117 . . . . 0.0 109.888 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -128.76 133.6 48.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.586 1.554 . . . . 0.0 109.384 -175.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.62 158.87 20.74 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 10.9 tpt180 -84.16 133.97 34.59 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -117.23 65.92 0.73 Allowed 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 7.3 t -74.81 -1.04 20.35 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 124.464 1.105 . . . . 0.0 111.569 -167.913 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 33.8 mm . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -62.78 173.03 4.03 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 N-CA-C 108.417 -1.417 . . . . 0.0 108.417 152.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -112.63 166.01 11.73 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 165.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -62.51 161.51 26.29 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 123.52 0.512 . . . . 0.0 110.409 167.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.75 -5.97 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.464 2.776 . . . . 0.0 112.784 170.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.44 ' CG ' ' H ' ' A' ' 7' ' ' SER . 25.5 t70 -141.87 -159.43 0.97 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 128.086 2.554 . . . . 0.0 105.707 178.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.44 ' H ' ' CG ' ' A' ' 6' ' ' ASP . 4.8 t -64.55 162.47 15.4 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.7 1.136 . . . . 0.0 111.142 177.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -108.66 14.88 24.15 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.524 1.53 . . . . 0.0 111.156 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.82 70.43 6.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.035 1.734 . . . . 0.0 111.019 -171.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -102.95 114.68 43.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 C-N-CA 126.41 1.884 . . . . 0.0 106.902 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.95 151.14 93.95 Favored Pre-proline 0 CA--C 1.541 0.6 0 C-N-CA 122.745 0.418 . . . . 0.0 110.239 176.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -80.28 179.44 6.15 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 123.449 2.766 . . . . 0.0 112.237 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.86 145.86 40.15 Favored Pre-proline 0 C--O 1.242 0.69 0 C-N-CA 125.874 1.67 . . . . 0.0 112.458 -172.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -74.92 179.41 6.09 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.74 2.96 . . . . 0.0 111.654 174.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 57.96 170.66 0.05 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.014 1.725 . . . . 0.0 110.309 -165.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.7 t30 -166.11 148.25 6.14 Favored Pre-proline 0 C--O 1.238 0.454 0 O-C-N 121.161 -0.962 . . . . 0.0 108.581 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -63.26 -26.61 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.753 2.302 . . . . 0.0 111.276 173.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.13 4.11 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -99.52 -13.99 19.24 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 120.138 1.335 . . . . 0.0 111.126 165.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.46 -20.11 34.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.696 1.134 . . . . 0.0 112.883 -172.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -8.5 33.33 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 120.577 -1.327 . . . . 0.0 113.572 176.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.79 13.78 29.29 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.374 1.07 . . . . 0.0 109.867 -177.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.81 31.25 0.36 Allowed 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.007 -1.058 . . . . 0.0 110.543 177.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -85.04 -54.53 4.58 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.403 0.681 . . . . 0.0 110.044 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -118.39 2.65 11.88 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.8 1.64 . . . . 0.0 113.398 -173.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.8 p -78.97 156.33 28.53 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 123.229 1.49 . . . . 0.0 111.344 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.66 154.54 51.48 Favored 'General case' 0 N--CA 1.441 -0.925 0 O-C-N 120.332 -1.48 . . . . 0.0 109.063 -177.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 32.3 m95 -152.9 162.18 41.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -164.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.9 t -144.66 132.82 17.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 tp -81.15 150.95 28.49 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.6 t -139.22 -23.4 0.9 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.62 161.15 43.13 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.227 -1.546 . . . . 0.0 110.224 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -140.31 139.28 35.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.772 1.629 . . . . 0.0 107.315 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.99 135.99 54.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.739 1.616 . . . . 0.0 109.683 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -69.19 160.89 30.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 109.191 163.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.01 73.64 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 111.977 172.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.89 -4.13 42.2 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.612 -0.68 . . . . 0.0 111.72 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.85 -3.05 62.37 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-O 118.26 -1.3 . . . . 0.0 112.178 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.6 m -60.67 103.95 0.3 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.053 1.427 . . . . 0.0 107.742 170.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.5 132.9 55.39 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 165.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.91 147.58 26.19 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 169.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.26 144.25 54.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 161.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -141.67 152.34 62.67 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 126.129 1.772 . . . . 0.0 106.776 170.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.08 117.29 4.62 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 121.192 1.261 . . . . 0.0 108.894 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -76.22 174.36 10.22 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.37 72.21 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.189 -0.944 . . . . 0.0 111.215 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -77.66 -7.23 56.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -79.24 -9.0 59.47 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.341 -0.849 . . . . 0.0 111.937 168.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.27 -23.7 17.8 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 118.741 -1.033 . . . . 0.0 113.179 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.02 76.7 21.73 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.632 1.173 . . . . 0.0 110.426 -168.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.87 128.21 21.43 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 122.331 2.021 . . . . 0.0 110.27 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.5 mm -60.28 96.52 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.202 1.801 . . . . 0.0 109.805 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.9 p -108.55 122.34 46.86 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.35 1.06 . . . . 0.0 108.858 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -109.28 140.5 42.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.72 1.608 . . . . 0.0 107.877 -177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 m -139.61 122.78 16.91 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -92.7 136.49 33.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 156.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.7 t 174.55 -154.82 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.718 2.807 . . . . 0.0 106.044 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.3 p -123.84 42.49 3.22 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.94 1.296 . . . . 0.0 111.913 -172.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.86 -6.75 2.95 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 119.546 -1.971 . . . . 0.0 114.729 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 70.8 p -122.94 -1.41 8.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.583 1.553 . . . . 0.0 112.06 166.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.55 -7.18 74.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.372 1.463 . . . . 0.0 113.24 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -89.68 170.33 10.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.005 1.903 . . . . 0.0 109.143 170.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -69.75 86.23 0.49 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 160.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.5 141.33 47.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.849 1.66 . . . . 0.0 107.388 -171.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.7 151.37 23.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.23 132.03 22.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 162.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.76 164.92 33.87 Favored Glycine 0 C--N 1.33 0.195 0 O-C-N 121.141 -0.974 . . . . 0.0 110.924 -178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -95.5 120.52 35.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -83.12 -158.67 0.29 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.591 1.156 . . . . 0.0 108.378 166.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -72.36 -17.86 77.88 Favored Glycine 0 CA--C 1.526 0.748 0 O-C-N 121.082 -1.011 . . . . 0.0 114.597 -170.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 44.0 t -150.88 -41.32 0.12 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.221 0.609 . . . . 0.0 109.666 162.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -103.47 105.7 16.03 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-O 122.17 0.986 . . . . 0.0 108.855 -170.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -60.11 148.95 34.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.298 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -139.43 174.14 10.82 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 124.595 1.158 . . . . 0.0 109.104 -163.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -155.54 166.09 34.6 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.456 1.903 . . . . 0.0 108.736 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.62 166.05 20.72 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.52 1.057 . . . . 0.0 110.537 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 p -72.33 166.1 23.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 118.383 1.092 . . . . 0.0 111.306 -177.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -142.01 175.27 9.87 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.621 0.768 . . . . 0.0 110.955 171.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.78 12.31 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.518 1.927 . . . . 0.0 109.737 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.27 99.33 12.37 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.216 1.807 . . . . 0.0 106.399 168.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.26 165.14 32.79 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.563 1.145 . . . . 0.0 108.413 173.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 37.3 t70 60.34 6.24 1.0 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.595 1.958 . . . . 0.0 114.92 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.2 27.91 69.88 Favored Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.119 -1.613 . . . . 0.0 111.696 -163.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.6 pttt -121.28 171.02 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.119 1.368 . . . . 0.0 109.089 166.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.3 tp -98.92 134.92 41.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 164.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.86 134.78 48.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 119.589 1.086 . . . . 0.0 108.538 166.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -90.41 -176.2 4.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.374 0.67 . . . . 0.0 110.362 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -120.92 -149.29 8.16 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 126.292 1.901 . . . . 0.0 109.508 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.9 t -69.66 85.98 0.47 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.5 mt -77.35 135.77 38.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.674 1.59 . . . . 0.0 109.363 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -169.32 168.88 41.59 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-O 121.638 0.577 . . . . 0.0 112.553 171.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.37 -168.83 13.25 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 125.1 1.333 . . . . 0.0 109.976 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.2 p -73.89 -179.05 3.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.54 1.136 . . . . 0.0 110.67 171.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -129.49 82.28 2.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.3 mtt -77.02 -175.87 3.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 167.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.84 110.69 16.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.081 0.953 . . . . 0.0 110.85 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 64.9 m -120.07 102.93 8.87 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 124.063 0.945 . . . . 0.0 108.552 164.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.45 57.16 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.643 2.777 . . . . 0.0 113.216 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -149.32 155.29 39.51 Favored Pre-proline 0 C--O 1.239 0.51 0 O-C-N 120.935 -1.103 . . . . 0.0 110.129 -161.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.62 -29.57 12.93 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.573 2.182 . . . . 0.0 111.126 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.11 -8.19 84.96 Favored Glycine 0 C--O 1.217 -0.945 0 CA-C-O 117.5 -1.722 . . . . 0.0 111.471 172.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.38 -59.12 2.07 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 120.769 2.284 . . . . 0.0 110.698 175.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.83 -12.26 60.25 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -165.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -65.15 -16.9 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 125.837 1.655 . . . . 0.0 113.335 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -45.38 -50.44 12.28 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.871 1.268 . . . . 0.0 111.319 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -56.52 -37.79 77.14 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-N 118.87 0.759 . . . . 0.0 112.179 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.25 63.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.256 1.028 . . . . 0.0 110.161 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -55.12 -48.09 74.1 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 15.0 mt -65.31 -38.73 91.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.938 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.08 -19.7 64.88 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -92.54 -43.95 8.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.734 1.214 . . . . 0.0 111.041 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.37 -18.14 60.78 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -175.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -72.63 -11.32 60.59 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.179 0.991 . . . . 0.0 113.066 174.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -124.45 56.39 1.28 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 120.333 1.424 . . . . 0.0 110.859 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.1 65.81 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.76 -31.61 59.61 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.193 -0.942 . . . . 0.0 109.997 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -124.19 162.81 22.86 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.004 1.321 . . . . 0.0 108.924 170.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.9 p -132.42 -163.7 1.37 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.081 0.952 . . . . 0.0 111.232 -162.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.8 83.5 0.04 OUTLIER Glycine 0 C--O 1.225 -0.463 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.998 156.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 5.2 p -97.86 151.0 4.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 119.109 1.454 . . . . 0.0 109.366 166.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.46 122.35 26.07 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 128.574 2.75 . . . . 0.0 104.474 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 4.0 ttm -114.01 42.55 2.02 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.752 2.021 . . . . 0.0 110.404 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -134.32 87.66 2.38 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.074 1.75 . . . . 0.0 107.973 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -47.72 133.79 10.93 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 125.897 1.679 . . . . 0.0 112.782 -162.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.66 122.61 7.92 Favored 'Cis proline' 0 C--N 1.346 0.441 0 CA-C-O 121.988 0.745 . . . . 0.0 113.083 4.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -82.06 126.77 32.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.346 1.058 . . . . 0.0 108.454 -174.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -141.73 149.16 40.14 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 55.5 ttp -126.98 141.57 51.76 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -170.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -112.82 150.06 32.19 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . 0.272 0.1 OUTLIER -127.21 153.07 46.55 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 127.036 2.134 . . . . 0.0 105.646 155.199 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 t -141.81 122.89 12.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 103.378 -2.823 . . . . 0.0 103.378 -176.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.4 169.29 17.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.122 0.963 . . . . 0.0 110.181 -176.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.5 p-10 -52.07 -26.73 11.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.675 164.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -2.66 45.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.991 1.269 . . . . 0.0 112.734 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.28 16.06 45.2 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 0.974 . . . . 0.0 114.549 166.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.67 172.25 5.44 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.301 -1.117 . . . . 0.0 108.862 171.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.9 m -146.82 116.55 7.17 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 119.095 -2.253 . . . . 0.0 109.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -105.16 161.16 14.5 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.646 1.178 . . . . 0.0 109.816 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 52.5 m -135.05 123.37 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.413 0.685 . . . . 0.0 110.195 -175.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -111.07 151.59 27.89 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 124.066 0.854 . . . . 0.0 111.531 165.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.59 150.4 20.75 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.843 1.257 . . . . 0.0 108.672 153.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -68.7 144.16 54.51 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 165.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.3 t -132.01 85.9 2.29 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 m -79.57 25.76 0.32 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.721 1.208 . . . . 0.0 110.67 167.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 . . . . . 0 C--O 1.247 0.952 0 C-N-CA 127.559 2.344 . . . . 0.0 110.571 -172.491 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -78.22 170.75 18.14 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 CA-C-N 121.176 1.456 . . . . 0.0 111.283 176.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.447 ' H ' ' HD2' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -59.66 154.66 17.34 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.68 1.192 . . . . 0.0 110.513 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -108.76 166.12 11.41 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 126.238 1.815 . . . . 0.0 109.206 -177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -69.6 65.7 1.69 Allowed 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.768 2.312 . . . . 0.0 110.424 164.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -81.17 177.49 8.99 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 126.144 1.777 . . . . 0.0 108.554 163.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 t -165.83 178.34 6.59 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 126.347 1.859 . . . . 0.0 107.773 172.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -85.46 15.78 4.25 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -125.12 82.51 2.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.019 0.928 . . . . 0.0 108.86 -178.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.5 t -136.75 163.64 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.57 163.57 52.91 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.23 1.012 . . . . 0.0 110.668 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -70.98 133.86 24.2 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.882 1.721 . . . . 0.0 108.371 162.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.4 165.29 53.93 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 126.709 2.004 . . . . 0.0 108.729 177.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.43 -165.95 0.25 Allowed 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.041 3.161 . . . . 0.0 111.125 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 65.08 84.06 0.16 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.484 1.913 . . . . 0.0 113.685 170.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -90.6 148.12 37.91 Favored Pre-proline 0 CA--C 1.536 0.434 0 O-C-N 120.764 -1.21 . . . . 0.0 112.624 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -65.0 -36.14 39.65 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.167 2.578 . . . . 0.0 110.498 169.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.7 21.56 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.87 2.068 . . . . 0.0 113.155 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -117.41 -18.58 9.8 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 120.177 -1.577 . . . . 0.0 111.722 169.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.3 m -72.24 -13.51 61.54 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.712 0.687 . . . . 0.0 111.89 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -79.96 2.09 24.9 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.044 1.338 . . . . 0.0 114.289 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.38 2.65 24.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.016 0.927 . . . . 0.0 110.427 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.88 -3.44 25.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.215 1.406 . . . . 0.0 111.964 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.07 -13.7 29.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 128.222 2.609 . . . . 0.0 113.531 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.66 -17.62 3.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.379 1.871 . . . . 0.0 112.582 -169.301 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.2 p -71.23 172.31 9.52 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.343 1.057 . . . . 0.0 111.281 -169.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 70.2 m -143.24 -57.82 0.41 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.325 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.5 m95 63.75 173.59 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.689 1.596 . . . . 0.0 113.982 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.1 t -142.96 127.45 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 175.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 36.2 tp -70.76 138.13 50.21 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -144.3 -20.71 0.55 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.88 155.63 49.54 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 120.595 1.543 . . . . 0.0 109.369 162.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -136.25 96.47 3.38 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 104.695 -2.335 . . . . 0.0 104.695 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -100.65 159.03 15.5 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 173.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -104.42 168.14 9.28 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 -174.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.15 -11.76 0.3 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.05 -3.33 12.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.63 1.104 . . . . 0.0 112.704 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.37 8.13 44.49 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 118.394 -1.226 . . . . 0.0 112.204 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.3 m -73.58 99.27 3.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.77 1.785 . . . . 0.0 109.025 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.67 110.92 2.18 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 163.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.9 mtt-85 -65.05 164.32 13.12 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.064 0.935 . . . . 0.0 108.936 169.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.63 144.04 28.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.049 165.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -146.17 163.05 32.43 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.038 2.135 . . . . 0.0 109.61 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.97 115.56 4.36 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 121.682 1.588 . . . . 0.0 109.825 170.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.69 172.77 10.83 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 122.957 0.503 . . . . 0.0 109.876 165.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.05 -44.67 79.06 Favored 'General case' 0 N--CA 1.462 0.168 0 O-C-N 121.61 -0.681 . . . . 0.0 109.943 172.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -65.38 -12.58 53.52 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -76.74 -5.07 46.57 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.579 -1.325 . . . . 0.0 113.095 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.72 -42.94 1.77 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 123.446 0.546 . . . . 0.0 112.407 167.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.89 82.74 63.32 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 125.286 1.435 . . . . 0.0 108.642 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.46 171.63 16.68 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 124.285 3.323 . . . . 0.0 111.452 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.9 mt -93.45 106.55 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 123.866 0.866 . . . . 0.0 109.594 176.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 p -81.59 162.46 23.12 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 166.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.21 163.71 26.11 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -154.89 129.26 9.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.507 -1.371 . . . . 0.0 109.54 178.017 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -135.1 66.2 1.53 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.272 1.429 . . . . 0.0 110.511 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -124.55 -172.86 2.65 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.134 0.974 . . . . 0.0 109.352 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.4 p -106.22 52.91 0.71 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.795 0.838 . . . . 0.0 110.31 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t -67.22 -21.5 65.75 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.984 -1.073 . . . . 0.0 112.76 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -96.4 1.59 51.86 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.404 1.456 . . . . 0.0 111.035 169.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.48 -1.04 10.11 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 126.146 1.831 . . . . 0.0 113.034 -167.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -99.47 172.34 7.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.889 1.844 . . . . 0.0 108.191 151.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -86.79 86.03 7.31 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 125.795 1.638 . . . . 0.0 107.078 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -120.02 106.54 12.11 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.331 1.452 . . . . 0.0 111.358 -162.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 143.69 44.63 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.922 2.089 . . . . 0.0 108.847 172.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.91 176.71 10.84 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 125.499 1.52 . . . . 0.0 108.384 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.68 163.49 20.52 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -89.46 109.84 20.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 162.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.5 t -85.62 172.62 10.76 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.396 0.998 . . . . 0.0 108.569 165.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.66 -40.15 6.37 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 126.499 2.0 . . . . 0.0 116.225 -155.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.4 t -116.62 -29.5 6.09 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.171 -0.605 . . . . 0.0 112.048 169.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -131.32 125.0 31.61 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.346 1.07 . . . . 0.0 108.468 -164.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.75 151.66 37.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.409 165.323 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -140.39 174.48 10.47 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.571 1.548 . . . . 0.0 109.131 -175.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.4 ptp -154.76 166.28 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 126.079 1.752 . . . . 0.0 109.684 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 167.0 -178.82 41.08 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.184 1.373 . . . . 0.0 111.151 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.6 p -108.86 120.09 41.48 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.951 -1.323 . . . . 0.0 110.963 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.2 p90 -88.94 -173.37 4.06 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -167.18 129.85 1.72 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.751 1.16 . . . . 0.0 109.723 166.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.0 139.28 34.63 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.621 0.646 . . . . 0.0 109.362 172.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 8.3 ptpt -168.94 157.72 8.22 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.409 1.884 . . . . 0.0 109.057 172.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 51.72 41.35 28.98 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.776 1.63 . . . . 0.0 113.735 170.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.11 1.98 11.86 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 120.145 -1.597 . . . . 0.0 114.09 -175.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -123.3 175.86 6.46 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 119.501 1.65 . . . . 0.0 110.731 -176.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 16.7 tp -114.82 124.79 52.64 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.9 p -107.44 153.52 22.69 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -121.31 153.51 37.62 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 125.486 1.515 . . . . 0.0 108.967 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -81.62 -175.43 50.27 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.064 0.84 . . . . 0.0 112.324 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -65.1 105.28 1.03 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 163.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 69.0 mt -88.94 166.71 13.75 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.594 0.757 . . . . 0.0 109.477 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.48 48.0 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.076 163.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -164.06 -121.06 0.55 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 76.6 p -128.15 -174.32 3.18 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.936 1.294 . . . . 0.0 109.944 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.3 mmm180 -130.46 45.46 2.81 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.224 1.81 . . . . 0.0 110.133 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.7 mtm -59.4 155.12 15.42 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.86 128.72 42.99 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 118.047 0.385 . . . . 0.0 111.053 -171.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 58.4 m -134.97 108.66 7.98 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 164.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 8.7 ptp -72.13 68.33 0.71 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 161.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 48.1 p -139.6 153.1 70.02 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.621 1.568 . . . . 0.0 108.394 173.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.88 -29.39 6.94 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.146 1.897 . . . . 0.0 110.561 174.507 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -72.9 -1.53 55.54 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-O 118.019 -1.434 . . . . 0.0 112.664 166.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -86.21 -58.53 1.96 Allowed Glycine 0 C--N 1.336 0.552 0 CA-C-N 119.552 1.676 . . . . 0.0 109.526 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.64 -10.19 43.49 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -167.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 tt -68.58 -15.5 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 O-C-N 121.32 -0.863 . . . . 0.0 111.935 174.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -44.83 -56.79 4.21 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.651 1.58 . . . . 0.0 110.959 173.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.6 -38.31 96.07 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-O 119.522 -0.599 . . . . 0.0 112.045 -177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.93 -41.77 82.03 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 117.696 0.748 . . . . 0.0 110.57 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -58.67 -51.7 68.81 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.231 1.013 . . . . 0.0 110.136 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.42 -42.61 78.3 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -11.02 60.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.76 -23.64 13.78 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 125.23 1.412 . . . . 0.0 111.049 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.88 64.49 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 120.025 1.284 . . . . 0.0 110.772 166.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 42.5 p -73.3 -1.31 17.47 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.17 -0.956 . . . . 0.0 111.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 -132.48 86.31 2.31 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.745 2.018 . . . . 0.0 106.854 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.9 mm -115.86 88.44 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 102.942 -2.984 . . . . 0.0 102.942 167.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -74.06 -42.11 60.7 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.469 -1.292 . . . . 0.0 108.796 169.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 -127.22 173.59 9.61 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.097 0.559 . . . . 0.0 110.98 -175.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 16.0 m -155.29 162.93 40.75 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 119.963 -1.71 . . . . 0.0 108.739 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.54 92.19 0.1 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 125.267 1.413 . . . . 0.0 109.737 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -90.87 135.64 26.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 118.195 0.998 . . . . 0.0 109.345 171.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -106.59 99.0 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 168.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 13.23 1.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.961 1.304 . . . . 0.0 112.697 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.81 132.12 54.44 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 126.782 2.033 . . . . 0.0 107.806 -175.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.91 124.45 58.3 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.273 1.429 . . . . 0.0 110.155 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.25 111.81 2.31 Favored 'Cis proline' 0 N--CA 1.457 -0.674 0 CA-C-N 120.364 1.166 . . . . 0.0 111.055 4.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -70.04 122.07 18.67 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -171.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -136.89 162.19 33.93 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.6 ttp -124.13 136.45 54.22 Favored 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 105.029 -2.211 . . . . 0.0 105.029 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -122.6 132.25 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 58.6 mt -136.55 153.65 50.93 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-O 122.884 1.326 . . . . 0.0 109.133 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.8 m -147.2 161.29 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.399 -3.001 0 CA-C-N 110.324 -3.126 . . . . 0.0 107.594 -160.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 8.4 mp -109.17 -174.58 2.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.494 -1.684 . . . . 0.0 107.56 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.73 -40.74 84.65 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 111.968 171.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -76.51 -20.63 56.73 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.495 0.589 . . . . 0.0 111.136 171.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.98 51.37 6.29 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 124.811 1.196 . . . . 0.0 112.826 -172.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.408 ' C ' ' HG1' ' A' ' 137' ' ' THR . 7.7 m-20 -49.93 171.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 117.916 0.858 . . . . 0.0 109.704 149.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' THR . . . . . 0.408 ' HG1' ' C ' ' A' ' 136' ' ' ASP . 52.4 m -150.21 92.37 1.87 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 119.601 -1.937 . . . . 0.0 109.685 -163.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 3.6 mp -100.02 113.38 25.93 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.893 0.877 . . . . 0.0 109.878 -173.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.5 m -77.1 128.15 33.92 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 173.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -124.38 132.23 53.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 164.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -84.21 137.72 33.34 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.211 1.404 . . . . 0.0 108.255 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 132.15 51.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.735 1.152 . . . . 0.0 108.016 173.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -141.38 68.98 1.33 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.917 1.341 . . . . 0.0 107.917 170.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 52.3 m -87.31 38.82 0.84 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.759 1.624 . . . . 0.0 106.844 159.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 47.2 mtt180 . . . . . 0 C--O 1.247 0.96 1 C-N-CA 132.508 4.323 . . . . 0.0 105.063 175.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 2.9 mp . . . . . 0 N--CA 1.471 0.609 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.12 160.61 39.56 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 121.681 1.587 . . . . 0.0 112.12 164.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.6 pttp 174.85 77.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.977 2.111 . . . . 0.0 110.846 175.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -114.19 152.62 46.06 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 124.461 1.104 . . . . 0.0 108.573 165.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -72.9 95.59 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.035 0 C-N-CA 123.211 2.608 . . . . 0.0 108.023 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -159.44 165.64 32.7 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 129.787 3.235 . . . . 0.0 105.744 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t 63.44 158.15 0.07 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.519 1.928 . . . . 0.0 110.899 -159.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -145.68 65.73 1.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.646 1.578 . . . . 0.0 106.95 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -153.67 110.62 3.41 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -63.37 108.97 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 157.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.52 156.34 38.63 Favored Pre-proline 0 C--O 1.239 0.552 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -64.86 131.09 27.9 Favored 'Trans proline' 0 N--CA 1.448 -1.199 0 C-N-CA 122.212 1.941 . . . . 0.0 108.051 171.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.93 155.76 91.65 Favored Pre-proline 0 C--O 1.241 0.658 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.51 -179.05 1.74 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.638 2.892 . . . . 0.0 111.593 175.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 69.63 164.57 0.26 Allowed 'General case' 0 C--O 1.235 0.295 0 C-N-CA 127.131 2.172 . . . . 0.0 111.403 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -134.79 143.91 48.37 Favored Pre-proline 0 N--CA 1.435 -1.207 0 C-N-CA 124.805 1.242 . . . . 0.0 108.615 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.429 ' C ' ' H ' ' A' ' 19' ' ' ALA . 39.7 Cg_endo -70.29 -23.75 28.01 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 122.385 2.057 . . . . 0.0 110.67 166.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.45 14.07 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.841 2.057 . . . . 0.0 113.812 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.429 ' H ' ' C ' ' A' ' 17' ' ' PRO . . . -123.65 -12.22 7.68 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.121 2.168 . . . . 0.0 112.286 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.4 m -82.7 -16.21 48.99 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 119.151 0.887 . . . . 0.0 112.384 -174.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -76.08 -0.72 22.85 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.82 -1.175 . . . . 0.0 114.141 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.2 3.11 51.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.291 0.636 . . . . 0.0 110.773 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.48 32.78 0.16 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.678 1.991 . . . . 0.0 112.511 -171.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -94.07 -35.35 12.61 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.612 -1.305 . . . . 0.0 111.467 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -141.16 19.86 2.26 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 123.077 1.417 . . . . 0.0 109.868 -165.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.1 p -84.64 -170.58 3.19 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.887 -1.133 . . . . 0.0 108.268 167.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -152.37 -61.46 0.16 Allowed 'General case' 0 CA--C 1.506 -0.712 0 O-C-N 119.326 -2.109 . . . . 0.0 111.642 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 m95 65.9 159.46 0.12 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.81 1.767 . . . . 0.0 115.23 176.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.461 HG22 ' HG ' ' A' ' 143' ' ' SER . 22.3 t -135.22 125.05 43.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 128.287 2.635 . . . . 0.0 107.845 174.694 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.62 126.5 27.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 170.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -126.85 -19.51 4.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 118.887 0.767 . . . . 0.0 112.085 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.08 156.4 43.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.974 -1.079 . . . . 0.0 110.635 163.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -132.1 100.27 4.99 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.95 139.14 33.52 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -80.93 170.59 16.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.73 0.812 . . . . 0.0 109.953 166.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.69 -35.23 74.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.329 0.652 . . . . 0.0 112.341 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -75.9 -12.31 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.601 -0.687 . . . . 0.0 111.824 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.98 14.02 32.39 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-O 118.808 -0.995 . . . . 0.0 113.039 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -79.01 108.99 12.9 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.263 1.531 . . . . 0.0 109.095 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 114.58 5.31 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.406 -0.809 . . . . 0.0 109.102 164.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 -64.61 163.64 13.34 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 124.677 1.191 . . . . 0.0 110.808 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.99 134.14 52.3 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 155.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.6 m -132.01 159.7 70.97 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 166.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.64 114.24 3.43 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.744 1.63 . . . . 0.0 110.983 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -71.22 173.27 7.92 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.185 -0.947 . . . . 0.0 110.288 170.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.76 -35.58 66.37 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.471 -0.768 . . . . 0.0 111.758 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -73.15 -20.9 60.81 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.037 0.535 . . . . 0.0 112.347 -178.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -73.35 -14.56 61.31 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.619 -0.676 . . . . 0.0 112.006 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.74 -19.46 54.53 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 124.398 0.999 . . . . 0.0 114.397 167.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -131.53 71.09 81.48 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 123.967 0.907 . . . . 0.0 109.738 171.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -63.21 156.95 52.37 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 122.223 1.948 . . . . 0.0 110.057 172.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.7 mt -89.8 134.9 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -130.51 165.5 22.55 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -135.14 155.04 51.38 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 175.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.2 m -151.73 115.15 4.8 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.387 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.7 113.56 25.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 170.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -161.75 -174.42 4.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.6 p -134.29 27.82 3.77 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.533 1.133 . . . . 0.0 112.116 -171.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 63.8 m -44.93 -36.48 3.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.052 1.741 . . . . 0.0 114.286 172.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.9 t -72.96 -28.75 62.59 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.669 1.122 . . . . 0.0 111.143 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.01 -23.54 5.54 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 127.536 2.494 . . . . 0.0 111.962 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 -117.57 172.21 7.49 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.852 1.661 . . . . 0.0 109.57 177.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -61.57 93.46 0.04 OUTLIER 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.262 1.025 . . . . 0.0 110.552 167.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -131.06 120.63 23.7 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 126.546 1.938 . . . . 0.0 107.14 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.94 30.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.985 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.2 p -152.79 174.25 14.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 159.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 163.89 -165.3 36.92 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 174.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -121.12 127.66 51.81 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.411 ' H ' ' HA ' ' A' ' 73' ' ' ARG . 2.5 p -93.78 -7.15 44.31 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.246 1.418 . . . . 0.0 112.784 -175.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 143.67 -44.8 0.92 Allowed Glycine 0 C--N 1.336 0.556 0 CA-C-N 118.382 0.537 . . . . 0.0 112.005 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 5.4 p -157.98 -32.03 0.07 Allowed 'General case' 0 CA--C 1.52 -0.201 0 O-C-N 120.86 -1.376 . . . . 0.0 111.717 173.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.63 -0.02 46.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -173.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.411 ' HA ' ' H ' ' A' ' 69' ' ' SER 0.278 0.8 OUTLIER 48.01 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 127.471 2.308 . . . . 0.0 113.385 -175.211 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -154.53 164.97 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.498 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.28 173.73 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.493 2.717 . . . . 0.0 107.707 167.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 148.53 174.69 20.44 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 125.628 1.585 . . . . 0.0 110.146 170.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.5 p -71.93 169.18 16.4 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.714 0.769 . . . . 0.0 110.755 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -148.99 174.78 11.91 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.471 0.708 . . . . 0.0 109.334 167.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.94 148.62 23.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.871 1.268 . . . . 0.0 108.983 169.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 114.4 26.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -151.11 166.26 31.35 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 53.55 13.4 0.47 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.233 1.813 . . . . 0.0 115.463 174.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.43 17.34 78.92 Favored Glycine 0 CA--C 1.531 1.059 0 O-C-N 120.495 -1.378 . . . . 0.0 112.56 -170.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -131.33 179.24 6.14 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 127.195 2.198 . . . . 0.0 110.129 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.05 109.39 20.82 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 104.433 -2.432 . . . . 0.0 104.433 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 57.6 p -97.45 152.82 18.58 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.019 0.827 . . . . 0.0 109.629 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.0 -164.81 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 110.266 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.9 -156.68 8.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 125.931 1.729 . . . . 0.0 111.595 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 t -74.71 71.03 1.91 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 172.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.1 mt -66.36 155.06 38.42 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.54 1.136 . . . . 0.0 108.096 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.85 -175.88 43.62 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 169.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.15 -149.72 5.18 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-O 121.794 0.663 . . . . 0.0 111.558 -167.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.3 p -100.18 -172.14 2.16 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 124.227 1.011 . . . . 0.0 109.993 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 mmt180 -135.5 87.84 2.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 171.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.3 mtt -114.42 165.2 12.97 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.633 1.173 . . . . 0.0 110.075 173.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.57 150.43 47.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 122.774 1.273 . . . . 0.0 110.602 163.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -145.09 147.16 32.24 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 130.411 3.484 . . . . 0.0 106.637 163.8 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ptp -129.09 28.6 5.27 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.953 1.701 . . . . 0.0 109.835 -177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.7 p -132.02 154.22 81.63 Favored Pre-proline 0 N--CA 1.446 -0.666 0 C-N-CA 125.953 1.701 . . . . 0.0 107.663 -168.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.15 -41.93 11.89 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.303 1.335 . . . . 0.0 109.348 176.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -62.51 -17.14 56.51 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-O 118.003 -1.443 . . . . 0.0 113.268 176.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.86 -56.11 12.01 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 120.102 1.951 . . . . 0.0 110.869 167.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -73.94 -18.39 60.9 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.471 1.136 . . . . 0.0 113.047 -162.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 18.2 tt -66.77 -13.72 16.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 123.278 0.631 . . . . 0.0 111.403 172.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -50.06 -43.24 51.06 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 125.426 1.49 . . . . 0.0 111.439 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.71 -42.6 98.01 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-O 119.417 -0.657 . . . . 0.0 111.611 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.61 69.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.632 0.716 . . . . 0.0 109.638 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.72 -54.48 38.61 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.993 0.917 . . . . 0.0 110.477 -175.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.48 -50.05 66.18 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 174.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -48.31 74.23 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.89 0.314 . . . . 0.0 111.225 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.01 64.43 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.232 1.013 . . . . 0.0 112.88 -173.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.08 -14.72 61.45 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.782 1.174 . . . . 0.0 112.293 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 26.4 p -84.46 4.39 31.89 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 119.287 0.949 . . . . 0.0 111.368 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -133.38 80.88 1.9 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.43 2.292 . . . . 0.0 108.659 -171.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -118.03 51.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 119.331 0.969 . . . . 0.0 109.959 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.95 -32.58 73.02 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.973 -1.079 . . . . 0.0 111.622 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -128.32 168.09 16.02 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.182 1.393 . . . . 0.0 109.789 -175.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 t -162.97 -179.01 6.44 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.598 -164.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 172.3 69.79 0.04 OUTLIER Glycine 0 CA--C 1.534 1.221 0 CA-C-N 118.993 0.815 . . . . 0.0 114.279 -176.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.0 p -85.15 142.05 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-N 120.797 2.298 . . . . 0.0 109.078 171.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -105.76 96.2 6.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 166.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 32.2 tpp -81.96 60.62 4.88 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 110.14 2.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -48.23 132.34 12.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.893 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.57 119.82 5.5 Favored 'Cis proline' 0 C--N 1.347 0.493 0 CA-C-N 119.543 0.872 . . . . 0.0 111.3 -0.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.07 136.69 37.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -140.91 165.87 26.34 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.82 2.448 . . . . 0.0 105.605 171.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 27.7 ttp -131.29 128.88 40.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 174.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -112.62 146.39 38.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 169.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 37.5 mt -135.11 139.99 45.12 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 73.9 t -129.07 126.24 64.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 -168.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.9 mp -73.95 165.92 24.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 122.666 1.222 . . . . 0.0 108.733 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -58.01 -36.12 72.22 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.724 1.21 . . . . 0.0 109.892 167.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -72.04 -19.86 61.77 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.895 1.678 . . . . 0.0 110.498 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.44 12.54 57.06 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-O 118.307 -1.274 . . . . 0.0 114.388 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.33 145.59 47.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.09 1.945 . . . . 0.0 107.423 164.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 15.1 m -125.12 96.6 4.91 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 124.947 1.299 . . . . 0.0 109.163 -177.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.54 127.58 33.0 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.072 -1.018 . . . . 0.0 108.333 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 36.7 m -113.95 118.52 34.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.391 1.877 . . . . 0.0 107.644 -175.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -114.74 150.58 35.12 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.148 1.379 . . . . 0.0 108.785 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.13 149.3 21.57 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.279 1.031 . . . . 0.0 108.986 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.0 tpt85 -71.48 107.11 4.23 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 163.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' SER . . . . . 0.461 ' HG ' HG22 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -105.68 89.03 2.97 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 170.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 t -115.57 50.34 1.01 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 122.038 0.923 . . . . 0.0 108.91 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.019 -1.467 . . . . 0.0 107.778 -179.213 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 13.1 pt . . . . . 0 N--CA 1.468 0.444 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.59 -173.35 0.68 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.796 2.998 . . . . 0.0 111.238 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.94 169.4 0.23 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.9 1.28 . . . . 0.0 113.015 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -123.43 165.31 23.4 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 127.385 2.274 . . . . 0.0 108.655 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.48 82.46 2.39 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.946 2.43 . . . . 0.0 109.914 175.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -142.1 -169.51 2.95 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.912 1.685 . . . . 0.0 109.373 173.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.8 m -44.85 110.66 0.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.616 2.366 . . . . 0.0 114.753 -176.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -77.46 62.64 2.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.774 1.23 . . . . 0.0 107.7 159.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -136.14 34.33 2.82 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.306 1.042 . . . . 0.0 112.289 176.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -137.7 140.65 40.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 124.702 1.201 . . . . 0.0 110.003 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.09 150.45 8.08 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.035 1.334 . . . . 0.0 110.784 175.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.24 131.46 17.87 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.496 2.131 . . . . 0.0 111.704 -168.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.52 144.53 89.0 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 171.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.32 -164.56 0.12 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.399 3.399 . . . . 0.0 112.256 177.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 70.8 35.17 1.83 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.077 1.751 . . . . 0.0 111.585 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.07 144.71 58.2 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.215 1.406 . . . . 0.0 111.175 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.436 ' C ' ' H ' ' A' ' 19' ' ' ALA . 89.8 Cg_endo -79.18 -26.15 5.36 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.634 2.89 . . . . 0.0 111.474 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.69 30.32 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.114 1.365 . . . . 0.0 112.538 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 17' ' ' PRO . . . -120.71 -11.06 9.08 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.303 2.641 . . . . 0.0 110.558 173.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -59.63 -39.17 83.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.122 0.969 . . . . 0.0 112.389 -169.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -28.16 69.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.675 -1.265 . . . . 0.0 113.072 177.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.3 mp -81.86 34.68 0.4 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.947 1.699 . . . . 0.0 110.108 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.35 -6.45 17.16 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.461 1.105 . . . . 0.0 110.898 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -60.77 -27.81 68.26 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.294 1.837 . . . . 0.0 114.901 -166.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -102.14 -14.09 17.2 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.621 1.568 . . . . 0.0 113.083 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.2 p -89.43 174.88 7.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.756 -149.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 3.9 p -124.12 -73.96 0.63 Allowed 'General case' 0 CA--C 1.503 -0.84 0 O-C-N 121.13 -0.981 . . . . 0.0 112.388 -171.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 6.6 m95 69.82 162.68 0.23 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.584 1.954 . . . . 0.0 111.421 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.6 t -144.3 135.3 21.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 177.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.23 131.85 40.67 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.9 t -116.96 -26.17 6.97 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.626 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -153.87 146.38 24.07 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 121.325 1.875 . . . . 0.0 112.458 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 1.7 t90 -137.98 101.63 4.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 127.808 2.443 . . . . 0.0 107.36 -176.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -84.8 131.87 34.49 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 169.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.82 167.12 17.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 163.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.28 -29.72 66.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.114 0.884 . . . . 0.0 112.459 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.29 -16.83 28.52 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.757 0.708 . . . . 0.0 112.582 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.2 -1.81 11.56 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.703 1.144 . . . . 0.0 113.4 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 m -64.33 93.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.667 1.734 . . . . 0.0 109.096 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.4 107.22 0.63 Allowed 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.677 -1.264 . . . . 0.0 109.719 169.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.45 142.75 57.73 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.776 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.63 130.94 41.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.7 m -128.77 153.88 79.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 174.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -70.1 113.32 3.39 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.129 1.219 . . . . 0.0 110.26 -177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -62.14 169.15 2.88 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.338 0.655 . . . . 0.0 110.664 166.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.35 62.53 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.978 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -102.01 -9.26 20.77 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -68.81 -15.26 63.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.268 -0.872 . . . . 0.0 112.024 173.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.67 -79.57 0.28 Allowed Glycine 0 C--N 1.336 0.551 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.26 86.18 58.58 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 128.211 2.604 . . . . 0.0 108.13 -168.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.85 160.21 47.89 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.443 2.096 . . . . 0.0 111.594 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 26.6 mt -75.17 103.56 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 176.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 p -103.29 157.81 16.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.599 0.759 . . . . 0.0 109.644 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -127.21 157.92 38.51 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.516 1.127 . . . . 0.0 109.223 169.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.402 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -141.7 128.15 20.06 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.547 1.539 . . . . 0.0 108.328 163.205 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.98 121.13 38.53 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 126.457 1.903 . . . . 0.0 106.159 161.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -151.57 -167.72 2.88 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 173.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 p -131.26 21.82 4.81 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.755 1.622 . . . . 0.0 111.277 -171.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.3 t -63.28 -29.76 71.03 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.226 1.41 . . . . 0.0 113.819 -165.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -78.99 -10.73 59.92 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.098 -1.001 . . . . 0.0 111.346 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.16 -6.35 58.07 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 125.803 1.668 . . . . 0.0 111.667 -169.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -132.3 166.93 20.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.533 1.533 . . . . 0.0 110.215 -176.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.2 ptp85 -66.04 74.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.815 2.046 . . . . 0.0 111.944 173.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.25 140.9 36.78 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.39 148.11 38.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.3 p -152.3 166.75 30.83 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.58 -169.4 40.4 Favored Glycine 0 C--N 1.331 0.29 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.26 132.96 51.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 169.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.2 m -114.52 22.88 13.24 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.475 1.91 . . . . 0.0 110.836 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.56 -73.5 0.46 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-O 117.287 -1.84 . . . . 0.0 112.08 178.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -144.51 -4.92 0.76 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 121.579 2.69 . . . . 0.0 113.878 179.591 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.454 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 16.3 m120 -115.97 -6.27 11.99 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.226 1.411 . . . . 0.0 114.268 -172.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 61.98 174.86 0.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 131.493 3.917 . . . . 0.0 111.74 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -147.68 161.2 41.65 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.369 0.604 . . . . 0.0 111.719 170.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.8 164.83 37.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.576 2.351 . . . . 0.0 108.266 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.07 173.98 27.18 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 174.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.0 p -89.33 160.64 16.77 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 122.123 -0.633 . . . . 0.0 109.755 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -140.26 -174.62 3.99 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.756 -0.59 . . . . 0.0 111.75 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -153.19 165.76 34.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.627 1.571 . . . . 0.0 108.542 166.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 79.5 mt -128.88 105.43 8.22 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -163.08 170.34 18.08 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 126.181 1.792 . . . . 0.0 108.65 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.62 21.7 7.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.061 1.344 . . . . 0.0 112.966 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.36 19.88 64.8 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 118.467 -1.185 . . . . 0.0 112.653 -171.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -139.78 178.74 7.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.397 1.599 . . . . 0.0 111.19 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 tt -115.41 113.37 23.66 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.14 134.09 36.95 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 170.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -88.69 -172.78 3.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.08 -149.01 7.91 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 126.664 2.078 . . . . 0.0 109.641 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.0 t -61.56 110.34 1.45 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 mt -88.21 169.62 11.72 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.333 1.453 . . . . 0.0 109.4 171.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.55 177.59 46.51 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 158.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.1 -173.68 25.84 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 70.1 p -71.4 179.45 2.94 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.889 0.876 . . . . 0.0 111.425 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.49 47.65 2.51 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.183 1.393 . . . . 0.0 108.297 172.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.7 mtm -63.1 157.08 23.15 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -112.1 129.82 56.1 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 96.9 m -136.71 125.74 24.4 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.883 2.073 . . . . 0.0 108.319 -169.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.5 mtp -90.73 53.06 2.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.994 0.902 . . . . 0.0 109.795 -174.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.7 p -134.55 153.29 78.99 Favored Pre-proline 0 C--O 1.239 0.507 0 C-N-CA 124.394 1.077 . . . . 0.0 108.25 -170.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -72.63 -37.77 3.78 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.257 1.305 . . . . 0.0 108.883 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.07 15.64 6.36 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 118.056 -1.413 . . . . 0.0 111.933 172.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -113.19 -11.0 14.3 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-N 120.504 2.152 . . . . 0.0 111.855 163.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -88.39 -21.06 24.5 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 169.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.4 tt -71.16 -14.1 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 120.093 1.315 . . . . 0.0 113.179 -169.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.454 ' CD ' ' H ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -57.34 -41.44 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 121.004 -1.06 . . . . 0.0 112.516 -172.346 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.12 -47.44 87.57 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 124.346 0.974 . . . . 0.0 111.249 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.39 -51.42 67.62 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.755 0.778 . . . . 0.0 109.678 177.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -64.5 -40.57 95.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.487 0.315 . . . . 0.0 111.359 -170.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.3 mp -61.5 -37.19 82.78 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 121.256 -0.903 . . . . 0.0 110.467 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -21.16 65.07 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.36 -39.74 20.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.0 -13.5 35.99 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.134 0.974 . . . . 0.0 113.141 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 46.9 p -97.84 8.89 43.96 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.01 1.324 . . . . 0.0 110.838 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -134.96 65.21 1.57 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 109.637 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -100.85 79.37 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 169.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.83 -36.52 78.3 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 118.699 -1.2 . . . . 0.0 110.211 170.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.466 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -130.69 161.27 32.02 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.444 1.098 . . . . 0.0 110.966 -174.701 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.6 m -149.25 169.74 20.06 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 158.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -159.71 162.16 32.79 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 108.09 -2.004 . . . . 0.0 108.09 153.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 45.0 t -124.74 145.04 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -110.08 93.3 4.43 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 170.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.2 mtp -80.2 35.2 0.32 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.442 1.097 . . . . 0.0 111.495 176.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -132.12 124.71 29.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 -178.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.62 148.83 65.17 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.973 0.909 . . . . 0.0 110.573 -173.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.9 122.39 5.6 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 N-CA-C 108.895 -1.233 . . . . 0.0 108.895 -14.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -71.52 135.24 46.99 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.11 0.481 . . . . 0.0 110.705 -168.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -139.26 168.81 18.99 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.799 1.24 . . . . 0.0 109.282 174.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -132.2 143.63 50.08 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.666 1.986 . . . . 0.0 106.843 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -138.01 139.39 39.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.883 0.849 . . . . 0.0 110.333 -174.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.429 ' N ' ' CD1' ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -134.09 161.12 35.75 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 127.675 2.39 . . . . 0.0 109.516 176.881 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.466 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 25.2 t -133.54 136.55 54.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 103.642 -2.725 . . . . 0.0 103.642 172.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 1.4 mp -82.71 162.1 21.89 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 172.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -66.11 -26.57 67.52 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.483 0.659 . . . . 0.0 111.731 -173.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.36 -5.92 58.36 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.615 1.566 . . . . 0.0 111.619 176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 103.22 4.41 47.38 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.997 -1.446 . . . . 0.0 115.441 169.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -62.07 158.46 16.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.589 1.695 . . . . 0.0 109.25 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.0 m -128.54 115.25 17.83 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.806 1.242 . . . . 0.0 109.981 -176.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -116.03 152.23 33.96 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.722 -0.611 . . . . 0.0 109.61 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 98.1 m -145.49 119.79 9.58 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.567 -164.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -113.82 140.25 48.47 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 123.518 0.727 . . . . 0.0 110.28 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.4 136.11 33.98 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.415 1.486 . . . . 0.0 107.708 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -60.91 136.93 58.23 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 117.803 -1.094 . . . . 0.0 108.21 174.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' SER . . . . . 0.439 ' C ' ' H ' ' A' ' 145' ' ' ARG . 8.0 t -138.42 35.91 2.27 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 119.661 1.118 . . . . 0.0 111.189 172.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.9 m -76.75 25.21 0.14 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.943 1.297 . . . . 0.0 109.822 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 143' ' ' SER . 57.7 ttt180 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 127.85 2.46 . . . . 0.0 111.736 171.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 23.6 pt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 110.573 -0.158 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -72.81 169.36 22.23 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 122.311 2.008 . . . . 0.0 110.502 172.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -127.18 -29.78 2.72 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.717 1.207 . . . . 0.0 110.101 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -137.37 165.85 31.24 Favored Pre-proline 0 CA--C 1.534 0.357 0 C-N-CA 128.307 2.643 . . . . 0.0 107.634 171.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.73 -22.24 73.74 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.465 1.443 . . . . 0.0 113.103 178.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.2 t0 75.12 65.59 0.07 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.494 2.718 . . . . 0.0 109.184 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.4 m -157.14 169.03 25.72 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.542 1.537 . . . . 0.0 110.465 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.47 58.52 4.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 127.242 2.217 . . . . 0.0 108.799 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.71 40.41 1.08 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.204 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -148.28 151.3 13.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.12 155.76 91.39 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.527 0.731 . . . . 0.0 110.541 173.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.04 129.93 20.51 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.677 2.251 . . . . 0.0 110.91 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -67.68 144.33 97.46 Favored Pre-proline 0 C--O 1.241 0.627 0 C-N-CA 125.07 1.348 . . . . 0.0 109.975 -175.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.94 179.59 4.22 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.15 2.567 . . . . 0.0 112.042 -172.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 64.86 64.76 0.64 Allowed 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 125.386 1.474 . . . . 0.0 109.641 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -112.0 144.14 30.13 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.749 -170.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.46 -26.42 14.22 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.049 3.166 . . . . 0.0 111.902 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.77 49.82 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.584 171.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -156.16 -43.57 0.08 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.919 2.487 . . . . 0.0 108.26 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 m -60.8 -16.9 45.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.994 2.517 . . . . 0.0 114.206 -164.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -74.44 -24.05 59.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.943 1.697 . . . . 0.0 113.466 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -72.42 -4.42 30.08 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.467 1.507 . . . . 0.0 111.155 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 38.98 0.57 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.875 1.27 . . . . 0.0 111.278 -160.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.77 -51.54 7.14 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.692 0.797 . . . . 0.0 110.756 175.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.07 -3.09 28.16 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.211 1.004 . . . . 0.0 112.232 -158.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.61 167.24 11.6 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 123.059 1.409 . . . . 0.0 111.584 -156.185 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.9 p -141.72 155.69 45.64 Favored 'General case' 0 CA--C 1.496 -1.122 0 O-C-N 120.07 -1.644 . . . . 0.0 106.822 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.407 ' CE3' ' HB2' ' A' ' 128' ' ' MET . 9.1 m95 -145.62 169.07 19.16 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.433 -175.142 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.0 t -136.02 124.03 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 169.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -79.98 129.82 34.79 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -178.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 -7.78 3.57 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.91 141.7 19.05 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-N 119.666 1.121 . . . . 0.0 111.389 173.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.412 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -127.47 118.81 24.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 128.562 2.745 . . . . 0.0 106.19 174.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -98.71 130.75 45.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -66.28 168.26 9.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 118.359 0.527 . . . . 0.0 109.793 163.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.13 71.61 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.479 1.111 . . . . 0.0 112.14 -174.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -23.57 63.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.811 0.339 . . . . 0.0 110.733 -177.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 110.33 3.14 29.4 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.663 2.078 . . . . 0.0 112.248 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.6 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.049 1.424 . . . . 0.0 108.807 177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.14 115.92 4.15 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 168.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.44 168.87 15.21 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.082 0.553 . . . . 0.0 109.623 172.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.75 152.3 27.06 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 151.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.4 m -140.36 165.65 28.79 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 125.983 1.713 . . . . 0.0 108.492 170.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -66.46 105.77 0.94 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.005 2.47 . . . . 0.0 110.454 169.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.406 ' H ' ' HG3' ' A' ' 48' ' ' GLN . 0.7 OUTLIER -73.18 174.87 7.37 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.563 1.145 . . . . 0.0 111.352 167.798 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.76 -49.33 76.93 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.932 0.493 . . . . 0.0 112.241 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.24 3.96 52.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.406 ' HG3' ' H ' ' A' ' 45' ' ' SER . 27.3 mm-40 -70.22 -24.99 63.19 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.328 -0.857 . . . . 0.0 110.641 171.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.66 -44.38 0.72 Allowed Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.306 0.955 . . . . 0.0 112.533 173.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.29 85.44 5.41 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 127.198 2.199 . . . . 0.0 109.953 -165.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -69.53 138.6 38.94 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 123.176 2.584 . . . . 0.0 112.807 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.4 mt -62.95 119.43 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.927 0.891 . . . . 0.0 109.61 163.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -124.37 119.28 28.79 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 172.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.35 144.23 48.34 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.911 1.284 . . . . 0.0 108.608 173.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.9 m -148.77 103.02 3.34 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 166.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -82.26 126.81 32.54 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 162.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.7 t -170.25 -159.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.89 51.2 1.13 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.932 0.893 . . . . 0.0 112.231 171.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.1 t -57.88 -39.5 77.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.395 1.078 . . . . 0.0 112.526 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.46 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 3.6 t -81.33 -10.93 59.46 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.571 0.748 . . . . 0.0 112.361 174.001 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.09 -12.25 40.77 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.177 1.37 . . . . 0.0 112.87 -173.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -120.87 162.32 20.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.591 1.695 . . . . 0.0 110.168 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.4 ptp85 -63.06 94.97 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.553 0.741 . . . . 0.0 110.861 176.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.46 ' CE1' ' HB ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -138.7 154.41 48.58 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.144 0.973 . . . . 0.0 109.284 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.96 92.86 9.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -169.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.2 p -98.09 66.49 1.83 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 122.257 1.027 . . . . 0.0 109.84 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.06 161.29 26.63 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.467 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 29.4 t80 -88.0 119.41 28.34 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 157.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -83.92 176.57 8.79 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 160.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.77 11.16 6.1 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.958 1.266 . . . . 0.0 115.374 -155.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -159.38 3.29 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 141.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -135.84 125.69 25.73 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 106.135 -1.802 . . . . 0.0 106.135 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.467 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -69.5 139.61 53.88 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.772 -0.58 . . . . 0.0 110.03 168.599 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -112.74 169.04 9.18 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 126.236 1.814 . . . . 0.0 108.86 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.7 ptp -157.5 146.47 19.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.054 1.742 . . . . 0.0 107.516 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.56 156.33 7.97 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.571 -0.612 . . . . 0.0 111.571 168.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -94.83 120.5 35.15 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 122.613 0.365 . . . . 0.0 111.969 -146.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.473 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 41.3 p90 -98.0 171.09 8.49 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.195 0.522 . . . . 0.0 112.175 -169.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.51 145.67 25.35 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 126.738 2.015 . . . . 0.0 107.993 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.73 117.43 29.32 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 170.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -159.23 3.12 0.09 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -173.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -137.82 9.65 2.84 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.088 0.955 . . . . 0.0 113.454 -161.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.97 11.4 50.93 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.252 -1.53 . . . . 0.0 112.01 -157.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -137.87 165.94 25.25 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 126.93 2.092 . . . . 0.0 109.49 169.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -75.08 146.52 41.4 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 128.362 2.665 . . . . 0.0 107.375 163.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m -127.47 138.14 52.87 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 153.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -85.48 164.12 18.03 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.14 -171.65 44.45 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.108 -1.997 . . . . 0.0 108.108 165.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 m -58.37 106.53 0.39 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 165.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.4 mt -82.81 156.37 23.69 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -154.2 167.01 32.27 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 165.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.09 179.46 21.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.613 0.707 . . . . 0.0 111.901 -174.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.0 p -67.18 172.13 5.01 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -120.52 77.34 1.26 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 169.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 30.5 mtt -76.86 158.78 30.55 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -98.11 111.89 24.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.219 1.408 . . . . 0.0 108.243 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 77.9 m -145.58 129.08 16.99 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.847 0.832 . . . . 0.0 110.998 -167.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.3 mtm -107.54 57.17 0.63 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.115 1.766 . . . . 0.0 107.521 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.8 p -142.58 150.79 55.49 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 123.34 0.656 . . . . 0.0 110.396 -164.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.99 -21.76 31.98 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.26 1.974 . . . . 0.0 111.236 176.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.86 -14.88 68.88 Favored Glycine 0 CA--C 1.524 0.645 0 C-N-CA 124.723 1.154 . . . . 0.0 112.935 173.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 -38.98 68.67 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 118.582 1.191 . . . . 0.0 111.411 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -92.5 -26.24 18.04 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.621 0.71 . . . . 0.0 112.445 -173.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.72 -14.15 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 119.388 0.995 . . . . 0.0 111.451 174.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -50.34 -43.87 54.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.121 0.969 . . . . 0.0 110.551 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.84 97.56 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.565 -0.614 . . . . 0.0 111.565 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.89 -37.11 75.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 117.622 0.711 . . . . 0.0 110.522 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -62.47 -48.77 78.14 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.567 0.747 . . . . 0.0 109.992 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.0 -33.04 74.57 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.89 0.768 . . . . 0.0 110.737 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.22 -32.96 74.71 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.964 0.802 . . . . 0.0 111.992 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.73 72.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 123.367 0.667 . . . . 0.0 109.545 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -13.8 50.24 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 117.435 -1.269 . . . . 0.0 113.574 175.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 p -79.9 -9.46 59.68 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 121.012 1.733 . . . . 0.0 111.686 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -121.14 26.78 8.78 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.458 1.103 . . . . 0.0 112.386 -163.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.2 mm -68.54 90.92 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -90.13 -25.56 20.64 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 121.569 -0.707 . . . . 0.0 111.108 169.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -133.87 166.65 22.19 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 126.167 1.787 . . . . 0.0 110.307 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 m -160.21 146.59 15.67 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.54 1.536 . . . . 0.0 107.932 174.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -125.37 138.06 10.71 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 160.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.41 144.24 23.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 164.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -124.79 76.99 1.56 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 -173.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.5 mtp -81.16 27.31 0.41 Allowed 'General case' 0 C--O 1.23 0.069 0 C-N-CA 126.314 1.846 . . . . 0.0 113.821 -174.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -121.51 109.06 14.37 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -51.52 126.22 29.53 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 124.271 1.029 . . . . 0.0 110.629 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.39 120.59 6.58 Favored 'Cis proline' 0 CA--C 1.534 0.52 0 O-C-N 122.63 0.805 . . . . 0.0 112.725 6.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -82.95 137.57 34.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.835 -0.541 . . . . 0.0 110.409 -170.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -142.51 175.85 9.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 107.573 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' MET . . . . . 0.407 ' HB2' ' CE3' ' A' ' 28' ' ' TRP . 7.1 tmm? -128.25 157.44 40.88 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 126.725 2.01 . . . . 0.0 105.937 172.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -155.15 112.03 3.27 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 169.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.411 HD13 ' H ' ' A' ' 138' ' ' LEU 0.333 0.4 OUTLIER -80.97 163.94 22.93 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 172.627 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.9 t -135.93 130.99 49.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 104.74 -2.319 . . . . 0.0 104.74 166.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 14.5 mt -83.11 164.8 20.03 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -54.7 -37.08 65.38 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.21 1.004 . . . . 0.0 111.679 173.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -80.22 -14.57 58.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.342 1.057 . . . . 0.0 111.993 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.38 -7.61 34.68 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.603 1.097 . . . . 0.0 114.613 174.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -55.02 144.65 22.75 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.265 1.532 . . . . 0.0 108.666 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.3 m -135.54 110.94 9.09 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 125.294 1.438 . . . . 0.0 108.013 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.412 ' CD1' ' HB2' ' A' ' 33' ' ' TRP . 0.1 OUTLIER -105.86 155.83 18.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 121.254 -0.903 . . . . 0.0 108.938 176.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 89.5 m -132.78 114.93 14.69 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.094 1.497 . . . . 0.0 108.946 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -124.81 139.54 53.75 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -175.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -93.79 142.65 27.13 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 123.787 0.835 . . . . 0.0 109.078 178.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -65.68 119.5 11.28 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 116.382 -1.771 . . . . 0.0 109.694 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 5.7 t -124.08 38.34 4.21 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.671 2.032 . . . . 0.0 113.217 -172.145 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.3 p -74.89 17.2 0.23 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.753 1.221 . . . . 0.0 112.214 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.973 0 C-N-CA 125.118 1.367 . . . . 0.0 113.292 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.3 pt . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.4 160.72 34.07 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.777 2.318 . . . . 0.0 112.017 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.03 -179.48 6.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.223 2.209 . . . . 0.0 107.394 173.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -89.51 165.11 27.03 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.305 1.042 . . . . 0.0 108.953 174.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.22 -10.52 29.19 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 122.791 2.328 . . . . 0.0 113.64 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 60.67 64.38 1.18 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.755 2.022 . . . . 0.0 111.503 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 t 75.13 -175.41 0.13 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.061 2.144 . . . . 0.0 110.928 177.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -110.68 63.19 0.61 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.913 1.285 . . . . 0.0 107.768 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.88 70.39 1.3 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.4 m -101.2 76.39 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 126.126 1.771 . . . . 0.0 107.467 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.7 154.94 33.08 Favored Pre-proline 0 CA--C 1.535 0.384 0 O-C-N 121.309 -0.869 . . . . 0.0 110.226 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.17 148.26 91.27 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 122.022 1.815 . . . . 0.0 108.214 177.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.412 ' CG ' ' HD2' ' A' ' 14' ' ' PRO . 2.1 t70 -92.89 159.82 35.16 Favored Pre-proline 0 C--O 1.241 0.635 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 13' ' ' ASP . 45.9 Cg_endo -69.79 -172.3 0.57 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.555 2.837 . . . . 0.0 111.815 -177.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 75.27 159.26 0.22 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 128.08 2.552 . . . . 0.0 112.33 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.455 HD21 ' HB1' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -147.39 149.79 35.55 Favored Pre-proline 0 CA--C 1.532 0.269 0 O-C-N 121.591 -0.693 . . . . 0.0 111.052 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.37 -32.34 8.2 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 123.891 3.06 . . . . 0.0 111.103 170.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.455 ' HB1' HD21 ' A' ' 16' ' ' ASN . . . -69.3 40.78 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.007 2.123 . . . . 0.0 112.243 175.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -143.03 -17.26 0.67 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.845 1.658 . . . . 0.0 112.069 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -31.64 72.22 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.49 1.496 . . . . 0.0 111.272 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -57.73 -20.47 34.8 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -173.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.33 6.23 38.16 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.638 1.175 . . . . 0.0 111.158 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -89.97 78.09 6.8 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.404 1.482 . . . . 0.0 108.373 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -134.45 -27.78 1.33 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -128.24 0.93 5.77 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.954 1.702 . . . . 0.0 111.118 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.9 p -74.27 -172.76 1.5 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 125.692 1.597 . . . . 0.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.471 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.4 OUTLIER -151.24 -63.9 0.19 Allowed 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.453 -1.404 . . . . 0.0 110.536 -176.41 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.2 m95 65.12 159.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 123.227 1.489 . . . . 0.0 112.438 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.5 t -140.97 129.61 24.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 103.744 -2.687 . . . . 0.0 103.744 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 39.6 tp -66.91 154.8 40.11 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.09 -20.8 0.25 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.46 -1.4 . . . . 0.0 111.67 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.26 140.05 29.0 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 118.753 0.706 . . . . 0.0 109.824 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -118.03 98.61 6.41 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.536 1.134 . . . . 0.0 108.442 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.55 134.33 34.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.477 ' C ' ' H ' ' A' ' 37' ' ' ASP . 26.8 mt-30 -74.96 166.96 22.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 123.011 0.524 . . . . 0.0 109.599 169.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.38 16.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 129.395 3.078 . . . . 0.0 115.226 172.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.477 ' H ' ' C ' ' A' ' 35' ' ' GLN . 0.2 OUTLIER -129.6 -18.38 3.53 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.377 2.271 . . . . 0.0 111.202 -179.487 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.14 3.99 35.74 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.255 0.931 . . . . 0.0 113.914 -175.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.7 m -88.08 113.27 23.55 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.615 1.566 . . . . 0.0 111.747 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.48 108.82 2.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.767 1.227 . . . . 0.0 113.343 165.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.11 161.51 8.53 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 126.096 1.758 . . . . 0.0 112.09 176.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 128.65 38.15 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 117.995 -1.002 . . . . 0.0 108.59 161.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.46 163.57 33.45 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 126.027 1.731 . . . . 0.0 108.318 174.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.2 107.59 2.23 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.652 2.235 . . . . 0.0 110.756 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.99 169.48 6.73 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.213 1.005 . . . . 0.0 111.536 170.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.96 -54.8 32.79 Favored 'General case' 0 C--O 1.231 0.124 0 O-C-N 121.632 -0.668 . . . . 0.0 110.451 175.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -10.53 52.56 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -176.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -75.99 -17.33 59.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.102 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.7 -88.34 0.2 Allowed Glycine 0 C--N 1.337 0.636 0 CA-C-N 119.306 0.957 . . . . 0.0 110.73 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.96 86.12 19.1 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.324 2.25 . . . . 0.0 109.129 -170.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -71.66 175.31 9.74 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.811 2.341 . . . . 0.0 112.079 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.85 110.38 22.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 127.915 2.486 . . . . 0.0 109.276 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 p -114.91 117.59 31.08 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.74 1.616 . . . . 0.0 109.072 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -81.99 165.33 20.78 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.471 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 3.6 m -145.55 134.78 22.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 163.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -119.99 97.87 5.81 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 174.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.3 t -150.66 159.36 44.56 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -176.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -108.46 59.56 0.61 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.896 0.771 . . . . 0.0 109.924 -173.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -32.79 69.53 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.129 -0.357 . . . . 0.0 111.092 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.4 p -90.53 10.18 26.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 111.516 177.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.87 -14.24 0.41 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 125.649 1.595 . . . . 0.0 113.596 -164.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.39 157.69 15.78 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 177.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.411 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.6 ptp85 -68.29 72.67 0.2 Allowed 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 126.17 1.788 . . . . 0.0 111.75 175.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 132.64 34.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.928 1.291 . . . . 0.0 110.854 176.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.7 118.04 36.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.14 154.89 50.15 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 168.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.33 169.68 42.56 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -175.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -96.96 125.49 41.42 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.475 ' HB2' ' CE2' ' A' ' 108' ' ' TYR . 28.3 t -109.27 91.1 3.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.949 0.795 . . . . 0.0 109.218 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 84.18 -64.84 4.2 Favored Glycine 0 C--N 1.332 0.355 0 CA-C-O 118.613 -1.104 . . . . 0.0 110.994 151.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -134.41 -1.07 2.89 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.647 1.224 . . . . 0.0 111.854 163.508 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -144.73 118.86 9.45 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.532 1.133 . . . . 0.0 108.493 -163.404 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.44 160.86 27.5 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.762 -1.211 . . . . 0.0 113.325 173.479 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -133.35 170.38 15.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.567 2.747 . . . . 0.0 112.061 -176.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -153.59 166.78 31.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.612 1.565 . . . . 0.0 111.597 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.69 -163.84 30.52 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.661 1.601 . . . . 0.0 110.25 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.4 m -127.71 155.26 44.26 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.373 1.469 . . . . 0.0 109.824 -164.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . 0.411 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 52.3 p90 -138.97 179.47 6.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -174.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.82 148.2 30.65 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.297 1.839 . . . . 0.0 109.578 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 mp -117.31 103.78 10.49 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.248 2.219 . . . . 0.0 107.089 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.39 -175.08 5.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.549 168.794 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 53.42 16.19 0.84 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 165.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.81 14.26 58.03 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.051 -1.656 . . . . 0.0 114.285 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.4 pttt -132.72 160.73 35.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.716 1.758 . . . . 0.0 111.26 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 17.1 tp -107.51 102.83 12.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 p -97.75 132.55 43.27 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.501 0.721 . . . . 0.0 109.077 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -96.19 -176.76 3.76 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.868 1.267 . . . . 0.0 109.944 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.67 -153.79 8.91 Favored Glycine 0 CA--C 1.521 0.45 0 C-N-CA 125.624 1.583 . . . . 0.0 111.062 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -64.27 85.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 123.228 1.489 . . . . 0.0 107.747 166.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 mt -78.34 178.31 7.77 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 119.923 -1.736 . . . . 0.0 108.52 169.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.97 -171.88 27.58 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 125.889 1.709 . . . . 0.0 109.41 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -179.43 -124.91 0.91 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 119.973 -1.108 . . . . 0.0 114.48 -171.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.1 p -102.59 169.67 8.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.346 1.058 . . . . 0.0 110.277 -165.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . 0.307 0.0 OUTLIER -128.05 40.91 3.59 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.294 1.038 . . . . 0.0 110.389 -174.914 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.0 mtt -58.8 140.9 54.44 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -91.14 124.89 35.7 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 91.3 m -136.99 169.09 18.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.121 1.368 . . . . 0.0 109.266 176.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.2 mtp -127.1 23.92 6.44 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.462 0.705 . . . . 0.0 110.26 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 43.8 p -101.89 158.75 31.17 Favored Pre-proline 0 C--O 1.238 0.481 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -168.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.22 -12.09 23.17 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.027 1.152 . . . . 0.0 112.159 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -92.61 -0.34 69.65 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 117.776 -1.569 . . . . 0.0 113.558 171.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.72 -45.67 4.19 Favored Glycine 0 CA--C 1.524 0.649 0 CA-C-N 120.239 2.019 . . . . 0.0 112.13 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -73.34 -22.5 60.29 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.812 1.306 . . . . 0.0 111.746 -174.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.7 tt -63.13 -14.33 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 O-C-N 121.503 -0.748 . . . . 0.0 112.352 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.466 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 5.3 tm-20 -66.56 -4.02 7.62 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.759 173.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.95 -64.17 1.9 Allowed Glycine 0 CA--C 1.533 1.214 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 164.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -33.29 74.47 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.287 -1.125 . . . . 0.0 112.626 -169.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.475 ' CE2' ' HB2' ' A' ' 69' ' ' SER . 0.4 OUTLIER -63.6 -36.59 84.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.503 0.721 . . . . 0.0 110.428 -171.398 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.449 HD13 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -75.43 -23.21 56.93 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.694 1.198 . . . . 0.0 111.117 176.65 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.18 -24.17 40.51 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 171.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.95 -39.74 61.17 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 123.218 0.607 . . . . 0.0 109.493 173.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.3 -14.51 27.32 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 56.8 p -82.35 -4.31 57.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.671 1.578 . . . . 0.0 112.494 175.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -118.2 84.07 2.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.229 1.412 . . . . 0.0 109.252 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.5 mm -128.37 60.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 177.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.29 -29.48 66.24 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.556 1.169 . . . . 0.0 110.048 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.505 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -141.03 158.29 44.14 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.03 1.395 . . . . 0.0 112.781 -178.507 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 130' ' ' LEU . 21.0 m -151.41 171.98 16.66 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 125.336 1.454 . . . . 0.0 108.495 174.245 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.64 99.33 0.18 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 108.528 -1.829 . . . . 0.0 108.528 172.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.7 p -100.61 136.24 33.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 O-C-N 121.263 -1.139 . . . . 0.0 108.987 177.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -107.8 76.65 1.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 79.0 mmm -71.74 50.92 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.707 -1.245 . . . . 0.0 111.824 175.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.5 tpp85 -134.99 129.12 33.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.19 130.03 94.26 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 117.647 -1.168 . . . . 0.0 109.849 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.89 119.45 6.16 Favored 'Cis proline' 0 CA--C 1.54 0.81 0 CA-C-N 119.7 0.928 . . . . 0.0 112.824 3.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -84.76 131.78 34.52 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.92 1.288 . . . . 0.0 109.691 -168.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -141.85 167.96 20.89 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 125.803 1.641 . . . . 0.0 108.95 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 7.5 tmm? -122.75 134.99 54.43 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -119.1 144.44 46.6 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 162.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 118' ' ' THR 0.305 0.1 OUTLIER -112.64 167.71 10.25 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.03 0.932 . . . . 0.0 109.072 160.491 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.505 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 59.4 t -124.0 147.87 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 157.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.11 161.03 15.27 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 172.18 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.21 -25.05 30.54 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.334 0.97 . . . . 0.0 111.526 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -82.43 -19.35 39.18 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 125.263 1.425 . . . . 0.0 112.009 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 113.94 -9.51 23.21 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.591 1.567 . . . . 0.0 114.484 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 148.19 23.97 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.64 1.72 . . . . 0.0 109.421 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.06 99.02 3.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.978 0.911 . . . . 0.0 108.682 -168.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.4 mp -86.75 142.7 27.95 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 119.733 -1.855 . . . . 0.0 108.504 177.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 90.1 m -109.22 125.22 52.01 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.755 1.622 . . . . 0.0 107.822 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -119.17 151.34 38.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 124.048 0.939 . . . . 0.0 110.453 176.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -99.32 147.83 24.79 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.937 1.695 . . . . 0.0 108.824 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -76.06 111.49 11.51 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 6.5 t -111.43 93.95 4.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 168.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 9.4 t -117.4 26.37 9.79 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.012 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.297 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -62.04 173.38 3.18 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.643 1.562 . . . . 0.0 110.722 170.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.53 174.92 8.31 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 163.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 59.3 m170 -64.83 165.11 16.66 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 153.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.05 71.14 3.58 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 122.364 2.043 . . . . 0.0 110.682 170.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -143.57 89.98 2.12 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 128.58 2.752 . . . . 0.0 104.428 168.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.87 176.69 2.15 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.662 1.585 . . . . 0.0 108.226 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 64.54 19.37 11.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.873 2.069 . . . . 0.0 116.473 152.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.16 46.47 2.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.315 1.046 . . . . 0.0 110.197 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.0 t -136.54 134.3 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.7 151.57 92.06 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 123.827 0.851 . . . . 0.0 110.83 177.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.78 126.83 10.37 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.675 2.25 . . . . 0.0 111.645 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -81.67 144.82 53.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 125.381 1.472 . . . . 0.0 108.958 174.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -71.04 177.88 5.98 Favored 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 123.711 2.94 . . . . 0.0 112.583 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 51.85 47.19 25.26 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.825 1.65 . . . . 0.0 110.677 -175.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -70.99 143.68 89.22 Favored Pre-proline 0 N--CA 1.454 -0.256 0 CA-C-O 117.681 -1.152 . . . . 0.0 108.883 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.406 ' C ' ' H ' ' A' ' 19' ' ' ALA . 66.5 Cg_endo -78.69 -16.75 12.89 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.959 2.439 . . . . 0.0 112.073 178.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.91 39.93 0.14 Allowed 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 122.751 1.262 . . . . 0.0 111.602 174.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.406 ' H ' ' C ' ' A' ' 17' ' ' PRO . . . -139.43 -46.22 0.46 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 130.065 3.346 . . . . 0.0 106.4 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.83 -20.69 62.16 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.593 1.157 . . . . 0.0 112.843 -176.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.3 -12.0 54.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 114.773 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 7.18 46.61 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.565 1.546 . . . . 0.0 110.589 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -82.15 56.32 3.14 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.381 -1.449 . . . . 0.0 109.312 -176.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -135.57 -40.22 0.71 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.623 -0.703 . . . . 0.0 112.296 -161.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.1 39.43 3.67 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 172.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 p -120.92 157.74 29.2 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.506 -1.371 . . . . 0.0 110.975 -174.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -127.6 152.47 47.6 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 123.99 0.916 . . . . 0.0 109.106 -178.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -149.59 162.5 40.07 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 113.257 -1.792 . . . . 0.0 108.604 -166.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.7 t -147.58 136.04 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.2 tp -82.25 150.65 27.19 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 119.276 0.944 . . . . 0.0 110.311 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 t -134.31 -27.32 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -151.79 157.97 42.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.309 1.413 . . . . 0.0 110.389 177.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.436 ' CD1' HD22 ' A' ' 138' ' ' LEU . 1.2 t90 -143.35 106.6 4.55 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.082 2.153 . . . . 0.0 108.469 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.07 131.61 34.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 172.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -61.53 161.61 9.38 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 159.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -44.32 -42.95 7.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.158 1.783 . . . . 0.0 112.654 165.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.23 -14.23 62.17 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.683 1.593 . . . . 0.0 111.987 -173.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.55 1.72 58.93 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.948 1.737 . . . . 0.0 112.64 -175.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.1 m -69.4 108.89 3.92 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.073 1.749 . . . . 0.0 109.794 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.39 140.36 48.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.153 -0.967 . . . . 0.0 110.64 170.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -97.05 166.47 11.58 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.436 1.494 . . . . 0.0 111.606 -175.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.5 102.99 13.96 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 173.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 28.0 m -114.43 148.89 41.21 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 173.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.7 102.69 1.64 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.137 2.558 . . . . 0.0 110.203 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.08 169.31 0.4 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 126.162 1.785 . . . . 0.0 114.442 168.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.87 -37.38 71.26 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.046 0.938 . . . . 0.0 112.873 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -80.86 -15.2 57.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -73.85 -22.92 59.59 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 121.589 -0.694 . . . . 0.0 111.515 -172.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.56 -32.14 2.34 Favored Glycine 0 C--N 1.337 0.604 0 N-CA-C 115.335 0.894 . . . . 0.0 115.335 156.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.17 85.26 8.2 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 172.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 162.28 39.82 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.035 1.823 . . . . 0.0 111.22 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.7 mt -77.99 106.85 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 124.537 1.135 . . . . 0.0 109.093 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -99.41 159.02 15.32 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.377 0.671 . . . . 0.0 109.629 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -140.16 141.97 36.0 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.402 2.281 . . . . 0.0 106.465 165.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.2 m -134.37 145.84 49.35 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 120.833 -1.167 . . . . 0.0 108.146 159.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.4 mt -118.4 117.32 28.74 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 103.71 -2.7 . . . . 0.0 103.71 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -163.54 178.7 7.79 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 171.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.0 p -116.92 16.46 15.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -161.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -51.72 -32.68 31.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.1 p -65.97 -21.82 66.44 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 121.336 1.88 . . . . 0.0 111.875 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.92 -0.03 60.47 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.897 1.713 . . . . 0.0 111.01 -160.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -131.27 167.8 18.6 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.106 1.453 . . . . 0.0 109.771 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -71.51 80.38 0.79 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.732 2.013 . . . . 0.0 106.742 173.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -106.07 112.79 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.518 1.527 . . . . 0.0 109.083 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.54 149.88 45.32 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 168.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -145.65 152.42 39.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 167.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 176.71 -168.74 40.9 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -131.55 128.73 39.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 103.34 -2.837 . . . . 0.0 103.34 172.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.4 m -119.59 11.19 11.97 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.443 1.02 . . . . 0.0 113.594 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 169.25 -63.09 0.18 Allowed Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.295 -1.281 . . . . 0.0 112.122 168.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 9.2 t -166.96 9.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.632 1.716 . . . . 0.0 113.713 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -112.06 -7.66 14.08 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 118.813 -2.429 . . . . 0.0 112.92 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . 0.321 0.0 OUTLIER 44.21 179.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 127.615 2.366 . . . . 0.0 113.07 -164.246 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 10.2 p90 -160.25 166.77 28.94 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.645 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -157.37 168.3 27.77 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.957 2.503 . . . . 0.0 106.392 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 143.9 175.88 17.42 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.431 1.015 . . . . 0.0 110.876 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.4 m -79.54 164.43 23.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -166.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -142.55 176.84 8.72 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.642 1.177 . . . . 0.0 111.541 170.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -158.3 159.23 35.71 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.147 1.379 . . . . 0.0 110.283 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.87 128.62 50.6 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 125.385 1.474 . . . . 0.0 108.817 -177.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt 176.18 171.58 0.4 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 128.111 2.564 . . . . 0.0 107.175 -171.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t0 58.3 24.13 11.21 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 158.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.01 5.78 59.0 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 118.251 -1.305 . . . . 0.0 113.998 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.5 pttt -131.31 168.41 17.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.806 1.803 . . . . 0.0 112.122 -171.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.5 tp -101.89 109.65 21.44 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 163.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -90.7 159.48 16.34 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -120.1 178.88 4.46 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.497 1.119 . . . . 0.0 110.126 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -101.87 -112.11 3.55 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 175.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 t -143.86 67.16 1.28 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 128.242 2.617 . . . . 0.0 105.284 -162.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.563 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -68.26 163.74 22.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.159 0.984 . . . . 0.0 111.031 -171.618 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.89 172.83 45.81 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 166.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.34 -134.46 2.8 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.2 p -103.22 -167.96 1.45 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.75 1.62 . . . . 0.0 109.774 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -128.24 67.47 1.36 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.045 1.738 . . . . 0.0 109.481 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.7 mtm -101.14 157.26 16.9 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.603 -0.685 . . . . 0.0 109.165 -176.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.27 118.72 32.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.038 0.935 . . . . 0.0 108.643 -171.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -102.37 -22.87 14.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 177.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.256 23.2 ptp 49.49 31.36 3.98 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -169.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 61.1 p -122.64 160.71 47.47 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.502 1.521 . . . . 0.0 107.47 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.8 -41.67 7.7 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.727 1.618 . . . . 0.0 111.632 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.93 -30.96 76.8 Favored Glycine 0 C--N 1.34 0.762 0 CA-C-O 118.699 -1.056 . . . . 0.0 111.005 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -68.98 -17.04 71.26 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.899 1.85 . . . . 0.0 113.242 173.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -98.91 -12.12 21.02 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.577 1.189 . . . . 0.0 112.385 -173.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.7 tt -81.95 -16.13 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -174.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -58.22 -37.65 75.26 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.911 0.778 . . . . 0.0 110.545 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.53 73.71 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-O 118.628 -1.095 . . . . 0.0 113.464 176.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.7 59.75 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 120.097 1.949 . . . . 0.0 110.158 173.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -71.52 -44.22 65.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.5 1.12 . . . . 0.0 110.668 -174.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.81 -28.17 68.59 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.566 -1.334 . . . . 0.0 111.272 172.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.56 -20.57 50.3 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 174.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.2 -37.61 25.8 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.457 1.503 . . . . 0.0 109.927 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -13.77 0.55 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.676 2.391 . . . . 0.0 114.584 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.3 p -114.96 -0.32 13.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.697 1.599 . . . . 0.0 113.09 -176.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -110.51 35.38 3.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.629 1.104 . . . . 0.0 109.973 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.3 mm -71.65 74.4 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.839 1.256 . . . . 0.0 108.017 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.87 -25.77 27.79 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.392 -0.817 . . . . 0.0 109.987 173.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -137.37 164.97 27.33 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 122.445 1.117 . . . . 0.0 112.609 174.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.4 m -158.6 162.91 37.36 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 127.577 2.351 . . . . 0.0 107.126 -176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.02 91.81 0.1 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 108.791 -1.724 . . . . 0.0 108.791 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.2 p -77.53 145.75 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 120.229 -1.748 . . . . 0.0 109.242 166.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -120.31 98.54 6.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.453 1.901 . . . . 0.0 107.401 174.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 12.2 mtp -88.42 1.79 54.01 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 177.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -61.81 132.08 51.96 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 157.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 140.73 98.16 Favored Pre-proline 0 N--CA 1.442 -0.852 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 170.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.42 118.68 4.71 Favored 'Cis proline' 0 N--CA 1.454 -0.8 0 CA-C-N 119.861 0.986 . . . . 0.0 110.558 -1.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -68.46 127.32 32.57 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.742 0.782 . . . . 0.0 109.213 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -140.41 161.49 37.57 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.286 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 40.2 ttp -115.39 148.87 38.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -130.21 133.61 46.68 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 176.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 52.7 mt -119.11 154.01 33.9 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.9 t -142.26 126.63 16.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.7 mt -84.45 170.91 13.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.452 . . . . 0.0 111.224 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -63.05 -2.17 1.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.56 1.944 . . . . 0.0 114.543 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -109.39 -10.29 14.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.89 1.676 . . . . 0.0 112.163 172.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.79 18.57 15.34 Favored Glycine 0 C--N 1.334 0.445 0 O-C-N 120.896 -1.128 . . . . 0.0 114.249 169.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.97 167.87 3.56 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.311 1.044 . . . . 0.0 110.982 174.973 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -139.66 104.15 4.85 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.348 -0.845 . . . . 0.0 109.059 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.436 HD22 ' CD1' ' A' ' 33' ' ' TRP . 0.6 OUTLIER -92.57 160.74 14.89 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.907 -1.12 . . . . 0.0 110.973 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 2.6 m -134.85 110.7 9.34 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 122.572 0.349 . . . . 0.0 111.201 -174.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 -114.06 140.98 48.02 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 123.972 0.795 . . . . 0.0 110.387 173.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -85.97 147.27 26.3 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 163.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -64.51 137.07 57.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 160.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 36.5 t -123.91 104.58 9.01 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 120.197 1.362 . . . . 0.0 107.99 163.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.3 t -123.12 17.59 9.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 123.489 0.493 . . . . 0.0 111.316 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? . . . . . 0 C--O 1.251 1.172 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 154.499 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 120.358 0.123 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.39 151.66 59.89 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.707 2.271 . . . . 0.0 110.401 172.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.84 136.38 28.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 169.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -87.81 167.61 19.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.381 1.873 . . . . 0.0 110.611 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -76.48 -5.28 15.97 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.853 2.369 . . . . 0.0 113.937 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 59.17 21.02 9.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.064 1.745 . . . . 0.0 112.656 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.0 m -73.64 105.34 4.92 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.564 1.146 . . . . 0.0 110.42 -175.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -162.64 108.15 1.18 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 128.592 2.757 . . . . 0.0 107.548 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 76.28 62.79 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 128.731 2.812 . . . . 0.0 110.323 170.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.77 155.11 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 C-N-CA 125.391 1.477 . . . . 0.0 109.558 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.16 156.86 66.37 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 126.398 1.879 . . . . 0.0 110.981 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -72.01 152.0 56.66 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.313 2.008 . . . . 0.0 110.459 176.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.85 159.63 81.53 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 125.103 1.361 . . . . 0.0 110.594 174.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -72.54 -167.87 0.36 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 124.065 3.177 . . . . 0.0 111.307 171.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 75.07 171.45 0.28 Allowed 'General case' 0 C--O 1.235 0.307 0 C-N-CA 128.115 2.566 . . . . 0.0 110.704 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -159.25 144.13 11.51 Favored Pre-proline 0 N--CA 1.468 0.47 0 O-C-N 121.301 -0.875 . . . . 0.0 111.583 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.79 -18.98 18.86 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.317 2.012 . . . . 0.0 111.942 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -13.32 23.62 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 119.23 0.923 . . . . 0.0 112.388 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.68 -25.64 49.68 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 119.726 1.148 . . . . 0.0 112.702 172.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -63.33 -31.02 72.07 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.822 0.849 . . . . 0.0 112.389 -160.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -21.8 66.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.753 0.706 . . . . 0.0 112.23 -175.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.0 mt -83.84 -9.43 58.77 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.449 1.1 . . . . 0.0 111.465 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.95 -13.52 62.49 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.813 0.845 . . . . 0.0 112.098 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -60.46 -9.82 4.15 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.801 2.04 . . . . 0.0 112.87 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -128.58 10.0 6.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.595 1.958 . . . . 0.0 111.483 -165.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.8 p -113.69 -174.76 2.53 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.463 -162.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.454 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -153.01 -66.58 0.16 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 118.211 -0.9 . . . . 0.0 112.186 -171.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.4 m95 65.88 171.29 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.91 1.284 . . . . 0.0 113.769 176.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.7 t -139.12 135.84 42.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 172.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.2 tp -74.44 143.24 44.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.83 -21.34 0.72 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 175.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -142.49 166.89 23.44 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 120.632 1.56 . . . . 0.0 111.388 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' ' CE1' ' A' ' 108' ' ' TYR . 5.9 t90 -150.65 101.48 2.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.06 2.144 . . . . 0.0 107.492 -176.02 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.6 145.11 25.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 170.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -88.44 172.31 9.46 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.386 0.674 . . . . 0.0 109.542 162.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.91 -34.48 73.25 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.273 1.029 . . . . 0.0 112.836 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.55 5.41 20.93 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.047 0.451 . . . . 0.0 110.823 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.61 11.66 60.41 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.221 1.391 . . . . 0.0 111.439 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 m -74.19 99.32 3.37 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 120.85 -1.383 . . . . 0.0 108.398 -174.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.5 104.36 1.24 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.158 0.98 . . . . 0.0 108.878 168.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 -59.4 157.5 11.01 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.78 1.232 . . . . 0.0 110.118 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.74 124.36 27.15 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.17 150.19 75.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.78 104.44 1.91 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.951 2.434 . . . . 0.0 110.179 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 169.26 11.24 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.006 1.322 . . . . 0.0 108.565 173.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.93 -46.43 71.53 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.786 -0.571 . . . . 0.0 111.618 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.34 -10.4 58.91 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -76.33 -12.04 60.0 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.851 0.86 . . . . 0.0 112.152 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.15 -32.97 4.54 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 124.337 0.97 . . . . 0.0 112.723 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.14 85.85 13.53 Favored Pre-proline 0 N--CA 1.449 -0.486 0 C-N-CA 125.993 1.717 . . . . 0.0 109.268 -171.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.3 132.8 32.69 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.76 1.64 . . . . 0.0 108.676 168.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.3 mt -69.99 98.95 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 O-C-N 121.913 -0.492 . . . . 0.0 109.821 173.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.9 p -75.9 154.0 36.32 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 171.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.67 155.04 39.85 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 172.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 17.6 m -141.9 137.4 31.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 87.1 mt -128.99 60.4 1.55 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.272 1.429 . . . . 0.0 107.947 174.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.8 t -134.78 172.32 13.13 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.629 1.172 . . . . 0.0 108.238 -171.421 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -95.52 44.2 1.09 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.282 -1.511 . . . . 0.0 111.408 -160.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -13.38 6.04 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 p -121.18 0.03 10.04 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.158 2.183 . . . . 0.0 112.411 170.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.17 -39.79 2.66 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 127.991 2.71 . . . . 0.0 111.897 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -82.97 172.88 12.31 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.05 0.94 . . . . 0.0 108.691 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -75.87 76.47 2.79 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.956 0.884 . . . . 0.0 110.484 171.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -102.98 123.82 47.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.946 1.698 . . . . 0.0 106.992 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.96 144.49 31.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.872 1.669 . . . . 0.0 107.138 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.25 173.54 11.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 164.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.03 -168.72 38.57 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -135.02 95.19 3.26 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.0 m -73.66 77.37 1.52 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.054 1.341 . . . . 0.0 110.868 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.07 -63.57 1.65 Allowed Glycine 0 C--N 1.333 0.373 0 C-N-CA 125.003 1.287 . . . . 0.0 113.857 158.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.7 m -114.22 -16.95 11.97 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 119.509 1.655 . . . . 0.0 111.219 170.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.71 124.56 18.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 -157.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -73.9 162.66 28.85 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.822 1.296 . . . . 0.0 111.41 163.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -145.7 146.8 31.41 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 130.8 3.64 . . . . 0.0 107.049 -175.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 35.0 mtm -147.29 152.24 37.95 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.5 2.32 . . . . 0.0 106.404 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.23 175.22 34.86 Favored Glycine 0 C--N 1.32 -0.356 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.6 m -78.92 155.03 29.19 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.817 0.808 . . . . 0.0 111.168 -175.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 49.1 p90 -125.69 177.14 6.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.714 1.205 . . . . 0.0 110.558 167.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.4 153.49 34.81 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.099 1.76 . . . . 0.0 109.484 174.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.49 101.3 9.74 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 126.884 2.073 . . . . 0.0 105.666 178.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -154.8 158.88 40.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.487 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.0 t0 44.59 33.42 0.92 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.138 1.375 . . . . 0.0 114.692 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 65.39 5.14 20.56 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 118.171 -1.349 . . . . 0.0 114.808 -175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -123.51 145.64 48.7 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 120.099 1.95 . . . . 0.0 110.986 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.82 119.9 16.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 169.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -123.98 152.44 42.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 119.037 0.835 . . . . 0.0 109.536 177.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -119.59 175.15 5.99 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -172.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.16 -112.48 3.71 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 125.322 1.439 . . . . 0.0 110.458 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -132.08 70.9 1.46 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 127.996 2.519 . . . . 0.0 105.44 -163.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.571 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -71.57 151.77 43.52 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.26 -172.286 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.14 162.99 21.3 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 107.315 -2.314 . . . . 0.0 107.315 172.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.17 -27.19 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.42 0 C-N-CA 119.602 -1.285 . . . . 0.0 113.698 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.5 p -163.85 170.01 17.42 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.346 2.658 . . . . 0.0 109.272 -167.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -128.85 29.35 5.24 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.793 1.637 . . . . 0.0 110.334 -175.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.6 mtt -60.38 141.28 56.52 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 111.137 -168.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -105.57 124.68 49.95 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.227 1.411 . . . . 0.0 108.49 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 59.2 m -127.01 167.85 15.35 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.001 0.92 . . . . 0.0 109.893 168.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 mtp -120.56 47.01 1.87 Allowed 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 -177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.9 p -132.83 156.98 79.48 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.97 1.708 . . . . 0.0 108.128 177.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -60.24 -47.95 13.24 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.967 2.444 . . . . 0.0 110.819 174.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.24 -11.37 58.93 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.922 -0.932 . . . . 0.0 112.115 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.85 -60.22 2.48 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 119.148 1.474 . . . . 0.0 111.521 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -75.95 -18.07 59.48 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.528 1.164 . . . . 0.0 113.939 -168.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.6 tt -60.97 -21.03 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.155 0.982 . . . . 0.0 112.467 176.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -45.77 -46.11 15.06 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.149 1.78 . . . . 0.0 110.52 174.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -66.08 -34.96 89.83 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.77 -1.206 . . . . 0.0 113.042 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.15 75.46 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.691 1.746 . . . . 0.0 110.358 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . 0.476 ' CE1' ' CZ3' ' A' ' 33' ' ' TRP . 10.1 m-85 -60.31 -62.09 2.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.079 1.352 . . . . 0.0 109.782 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.86 -23.29 63.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.426 -173.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -61.78 -59.21 5.5 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 123.012 0.525 . . . . 0.0 110.199 168.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.56 -29.82 70.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.907 1.283 . . . . 0.0 110.902 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tp -56.59 -21.21 25.23 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.935 1.294 . . . . 0.0 112.992 -175.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -85.96 -23.19 27.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.423 1.465 . . . . 0.0 112.223 177.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -94.42 37.95 1.11 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.475 1.51 . . . . 0.0 111.338 -166.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.7 mm -75.96 79.92 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 174.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -79.69 -30.31 41.06 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.433 -0.792 . . . . 0.0 109.982 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 20.5 mtm180 -132.98 173.62 11.21 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 127.549 2.34 . . . . 0.0 109.434 -176.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.8 t -159.23 -179.49 8.03 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -172.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.48 84.57 0.08 OUTLIER Glycine 0 CA--C 1.53 0.978 0 C-N-CA 123.691 0.663 . . . . 0.0 112.046 171.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . 0.293 1.7 p -88.88 120.96 38.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 119.101 1.45 . . . . 0.0 109.863 171.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -90.09 96.52 10.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 175.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 43.6 tpp -87.71 60.29 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.582 1.182 . . . . 0.0 108.181 177.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -153.38 135.95 15.16 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 171.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.31 92.89 Favored Pre-proline 0 N--CA 1.443 -0.822 0 CA-C-N 118.568 0.622 . . . . 0.0 110.212 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.5 119.05 3.65 Favored 'Cis proline' 0 N--CA 1.459 -0.536 0 CA-C-N 119.336 0.799 . . . . 0.0 110.262 -8.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -72.5 127.31 32.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 122.208 1.004 . . . . 0.0 108.514 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -142.77 159.68 41.77 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 126.209 1.804 . . . . 0.0 106.527 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.7 ttp -142.17 104.61 4.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -165.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -69.78 144.49 52.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 161.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.75 152.12 33.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 149.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 64.6 t -135.38 120.2 27.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -176.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.46 165.75 21.9 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.055 1.407 . . . . 0.0 111.079 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -53.94 -36.94 63.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.98 2.112 . . . . 0.0 111.273 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -81.82 -11.4 58.98 Favored 'General case' 0 C--O 1.226 -0.166 0 O-C-N 120.915 -1.116 . . . . 0.0 110.431 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.05 12.11 30.43 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 123.981 0.801 . . . . 0.0 113.902 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.18 166.19 5.08 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.172 1.486 . . . . 0.0 110.57 174.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.1 m -151.09 99.5 2.69 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 120.405 -1.434 . . . . 0.0 109.956 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -78.05 166.45 22.8 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 121.119 -0.988 . . . . 0.0 109.769 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 18.3 m -132.47 120.91 22.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -119.53 156.6 29.98 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.844 0.715 . . . . 0.0 110.09 168.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 131.09 53.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 126.863 2.065 . . . . 0.0 108.514 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.24 110.55 2.62 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.341 1.457 . . . . 0.0 110.427 -176.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.91 73.69 1.51 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 170.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.3 m -88.54 37.45 0.83 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 168.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.156 0 O-C-N 119.97 -1.706 . . . . 0.0 111.042 -172.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 9.4 pt . . . . . 0 CA--C 1.539 0.555 0 CA-C-O 119.665 -0.207 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.36 63.71 8.79 Favored 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 122.294 1.996 . . . . 0.0 111.069 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp 62.49 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.755 2.022 . . . . 0.0 109.239 -168.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.48 160.48 7.24 Favored Pre-proline 0 CA--C 1.534 0.357 0 C-N-CA 123.407 0.683 . . . . 0.0 111.449 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.07 -7.17 20.82 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.123 1.882 . . . . 0.0 113.044 173.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 t70 74.42 163.01 0.26 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.042 2.537 . . . . 0.0 112.15 174.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.4 m 59.94 11.2 2.48 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.003 2.521 . . . . 0.0 114.878 173.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -89.76 58.24 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.398 1.879 . . . . 0.0 110.39 -170.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.62 80.46 2.0 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 122.518 1.151 . . . . 0.0 109.863 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 56.28 51.53 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 127.572 2.349 . . . . 0.0 110.45 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.81 144.79 98.97 Favored Pre-proline 0 C--O 1.238 0.449 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.667 172.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.87 151.4 50.92 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.932 2.421 . . . . 0.0 109.622 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -93.82 144.76 28.67 Favored Pre-proline 0 C--O 1.24 0.569 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.04 -176.97 0.69 Allowed 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.307 2.671 . . . . 0.0 110.537 164.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 65.48 167.2 0.19 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 126.56 1.944 . . . . 0.0 112.698 177.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -142.03 143.31 27.65 Favored Pre-proline 0 N--CA 1.457 -0.106 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.734 -173.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.24 -35.79 2.78 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.493 2.128 . . . . 0.0 111.212 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.48 72.96 1.01 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.523 1.929 . . . . 0.0 108.94 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -173.51 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 129.672 3.189 . . . . 0.0 108.037 174.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.5 m -63.31 -22.99 67.22 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.177 -0.952 . . . . 0.0 111.689 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -56.8 -15.99 5.75 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.499 1.12 . . . . 0.0 113.416 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.0 mt -98.42 5.14 48.35 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.683 1.193 . . . . 0.0 111.853 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.11 75.01 2.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.939 1.696 . . . . 0.0 108.571 178.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -143.96 -29.29 0.5 Allowed 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 168.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -111.24 -5.52 14.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.892 1.277 . . . . 0.0 112.665 173.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.4 p -71.26 176.05 4.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.811 1.244 . . . . 0.0 110.814 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.3 -64.67 0.52 Allowed 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 120.594 -1.316 . . . . 0.0 110.696 179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 67.77 163.01 0.2 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.974 1.71 . . . . 0.0 112.949 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -140.83 136.41 34.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 48.5 tp -85.26 135.58 33.86 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.92 -12.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 176.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.98 151.51 39.84 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.762 1.619 . . . . 0.0 111.714 172.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -142.17 101.16 3.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.31 1.844 . . . . 0.0 106.813 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.51 140.44 29.53 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.075 -1.016 . . . . 0.0 108.556 170.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 18.5 mt-30 -78.67 170.13 17.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.823 0.738 . . . . 0.0 111.542 166.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -21.8 38.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.313 2.245 . . . . 0.0 114.757 -177.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -111.08 1.86 17.59 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.528 1.058 . . . . 0.0 112.049 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 117.36 0.67 18.58 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.054 0.835 . . . . 0.0 113.795 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.2 m -67.62 95.29 0.47 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.156 1.478 . . . . 0.0 110.156 -175.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.35 107.08 1.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 O-C-N 120.16 -1.587 . . . . 0.0 111.091 171.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -65.72 159.9 24.06 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.974 1.709 . . . . 0.0 110.94 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.24 34.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 170.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.9 m -137.52 164.73 39.43 Favored Pre-proline 0 C--O 1.236 0.39 0 C-N-CA 123.824 0.85 . . . . 0.0 109.148 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 112.97 3.6 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 121.947 1.765 . . . . 0.0 110.478 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -64.74 178.09 0.84 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.151 0.981 . . . . 0.0 110.245 162.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.76 99.8 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.396 -0.815 . . . . 0.0 110.241 165.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -32.24 73.8 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.332 1.453 . . . . 0.0 110.91 -174.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -59.5 -12.99 7.28 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.219 1.808 . . . . 0.0 113.479 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -45.16 1.36 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 124.098 0.856 . . . . 0.0 111.563 165.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.88 77.89 75.98 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.447 1.499 . . . . 0.0 109.087 -175.107 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.22 154.72 69.44 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 124.569 3.513 . . . . 0.0 112.138 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.45 100.07 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.051 0.94 . . . . 0.0 108.472 171.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.3 p -92.14 154.78 18.48 Favored 'General case' 0 C--O 1.241 0.647 0 O-C-N 121.816 -0.552 . . . . 0.0 110.068 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -121.28 155.33 34.91 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.068 1.747 . . . . 0.0 106.882 173.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 8.9 m -147.78 99.48 3.1 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.568 -0.707 . . . . 0.0 109.667 176.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.89 125.35 29.14 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.06 -164.34 1.59 Allowed 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 p -139.16 24.15 2.54 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.737 2.815 . . . . 0.0 110.679 -169.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.9 p -68.62 0.44 4.15 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -167.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.0 p -117.5 1.5 12.32 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.962 1.705 . . . . 0.0 110.933 171.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.4 -48.35 0.95 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 127.447 2.451 . . . . 0.0 110.564 -176.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -93.26 170.68 9.44 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.751 1.62 . . . . 0.0 109.157 -169.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -73.55 101.44 3.57 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -124.23 141.95 51.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.12 100.59 10.06 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 126.364 1.866 . . . . 0.0 106.715 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.2 t -108.35 148.43 30.09 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 164.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.38 -162.13 12.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 106.799 -2.52 . . . . 0.0 106.799 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -108.37 -11.99 15.11 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -171.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.2 m 51.52 -164.96 0.05 Allowed 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 129.886 3.274 . . . . 0.0 111.601 -172.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.49 -30.23 33.39 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.444 1.497 . . . . 0.0 113.247 172.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.0 t -174.91 0.06 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.486 0.715 . . . . 0.0 112.258 162.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.419 ' ND2' ' H ' ' A' ' 95' ' ' MET . 2.6 m120 -125.68 102.74 7.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 123.665 1.698 . . . . 0.0 109.575 -175.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.5 132.44 48.49 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.945 -171.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.07 165.14 12.65 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 128.153 2.581 . . . . 0.0 109.446 -164.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.5 mtm -152.45 156.59 39.77 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.512 -2.033 . . . . 0.0 105.512 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.69 175.83 30.06 Favored Glycine 0 C--N 1.318 -0.44 0 C-N-CA 124.607 1.099 . . . . 0.0 110.397 173.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.4 m -87.48 165.24 15.67 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 122.092 -0.652 . . . . 0.0 110.927 -173.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -145.96 178.33 8.27 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -159.07 155.89 28.21 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.073 1.749 . . . . 0.0 109.569 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mp -112.31 127.08 55.89 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 125.512 1.525 . . . . 0.0 107.754 175.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 169.36 15.01 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 124.795 1.238 . . . . 0.0 109.317 171.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.6 t0 44.66 44.88 7.77 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.739 1.616 . . . . 0.0 113.477 168.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.82 0.66 5.39 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 115.585 0.994 . . . . 0.0 115.585 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -127.33 172.2 10.84 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 126.227 1.811 . . . . 0.0 112.013 -166.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.03 103.31 9.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -174.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -90.86 151.51 21.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -118.08 -179.83 3.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 123.485 0.714 . . . . 0.0 110.698 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -107.61 -105.32 3.0 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 176.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 m -140.91 71.62 1.37 Allowed 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 -169.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.488 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -63.33 167.04 5.64 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.528 0.68 . . . . 0.0 111.033 -177.698 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.79 170.95 26.08 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 107.711 -2.155 . . . . 0.0 107.711 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -155.42 -156.08 7.62 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -160.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.4 p -76.88 -179.69 5.61 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 122.255 -0.556 . . . . 0.0 109.622 165.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -133.68 86.98 2.33 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 163.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' MET . . . . . 0.419 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 10.0 mtt -80.52 154.46 27.51 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 174.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.47 140.39 58.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 159.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 98.9 m -142.71 -19.27 0.67 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.481 1.113 . . . . 0.0 113.392 172.535 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.0 mtm 62.18 25.57 15.31 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.38 1.072 . . . . 0.0 113.739 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -123.81 161.56 45.81 Favored Pre-proline 0 C--O 1.24 0.562 0 C-N-CA 125.909 1.683 . . . . 0.0 110.233 -176.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.27 -33.0 19.42 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.68 2.253 . . . . 0.0 111.231 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -60.14 -33.75 81.07 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.967 0.794 . . . . 0.0 111.524 172.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.92 -43.19 99.65 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 118.076 0.938 . . . . 0.0 112.42 172.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -85.85 -33.25 21.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.138 0.969 . . . . 0.0 112.895 -170.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 17.6 tt -61.01 -18.29 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 118.819 0.736 . . . . 0.0 111.599 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -56.96 -36.21 70.02 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 121.352 -0.842 . . . . 0.0 111.858 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.86 -26.55 60.7 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.282 -0.732 . . . . 0.0 112.414 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.26 -40.17 15.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 118.697 1.249 . . . . 0.0 110.601 173.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -30.54 57.07 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 -158.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.1 mt -60.41 -38.94 85.6 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.808 1.243 . . . . 0.0 110.068 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -36.95 67.34 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 122.782 0.433 . . . . 0.0 110.361 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.95 66.09 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 122.083 -0.385 . . . . 0.0 111.288 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.88 -7.32 39.25 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.12 -0.943 . . . . 0.0 113.349 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.7 p -94.77 -11.68 28.54 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 120.789 1.631 . . . . 0.0 112.317 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -113.54 35.31 4.08 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.169 0.987 . . . . 0.0 110.782 -172.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 mm -72.15 72.96 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -75.92 -35.15 59.86 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 169.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -127.54 160.71 30.69 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.138 0.975 . . . . 0.0 110.731 -173.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -151.35 158.11 43.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.604 1.162 . . . . 0.0 107.961 169.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.51 108.37 0.44 Allowed Glycine 0 N--CA 1.441 -1.018 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 172.504 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 5.4 p -108.5 156.19 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 118.936 1.368 . . . . 0.0 111.174 169.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -136.92 112.07 9.06 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 39.5 ttm -108.45 66.99 0.65 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.514 1.526 . . . . 0.0 109.385 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -152.69 80.6 1.22 Allowed 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.789 1.236 . . . . 0.0 109.458 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -27.88 119.94 0.26 Allowed Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 127.697 2.399 . . . . 0.0 112.437 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.56 122.72 8.81 Favored 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.317 0.792 . . . . 0.0 111.758 15.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -83.28 141.91 31.49 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -172.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -141.53 170.13 16.31 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 161.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -143.22 142.34 31.38 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 127.732 2.413 . . . . 0.0 105.226 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.15 129.08 33.27 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 -174.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 97.1 mt -103.86 140.4 37.72 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.7 t -127.22 123.67 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.94 165.2 25.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -59.66 -33.15 71.18 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.578 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.05 -21.88 39.74 Favored 'General case' 0 C--N 1.341 0.207 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.406 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.15 6.45 12.26 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.37 -1.239 . . . . 0.0 115.407 168.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -61.68 133.64 55.83 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.587 2.193 . . . . 0.0 108.72 174.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.4 m -116.33 103.36 10.4 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.845 2.058 . . . . 0.0 108.265 -169.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.8 mp -94.55 114.18 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 51.1 m -86.03 124.31 32.32 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 170.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -99.35 163.4 12.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.484 1.514 . . . . 0.0 108.621 167.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.38 147.64 34.76 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.089 1.756 . . . . 0.0 108.279 163.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.2 tpt85 -81.15 109.41 15.67 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.8 t -91.27 108.52 19.94 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 105.03 -2.211 . . . . 0.0 105.03 163.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.77 16.77 17.33 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.693 2.397 . . . . 0.0 110.69 165.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.188 0 CA-C-O 116.52 -1.705 . . . . 0.0 107.126 164.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.6 pt . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 117.173 -1.394 . . . . 0.0 107.809 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -62.69 157.11 49.05 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 CA-C-N 120.124 1.08 . . . . 0.0 109.333 164.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.06 95.34 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 126.497 1.919 . . . . 0.0 110.48 -170.596 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -65.59 165.33 19.71 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.42 162.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.04 94.26 0.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.39 2.06 . . . . 0.0 108.199 163.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -132.25 166.36 22.06 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 130.888 3.675 . . . . 0.0 106.207 177.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.3 m -144.37 0.54 1.03 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -86.85 42.64 1.03 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.636 1.208 . . . . 0.0 112.494 -167.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.67 50.8 1.96 Allowed 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.878 -1.139 . . . . 0.0 110.528 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 p -148.8 123.61 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -153.94 160.97 30.35 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 123.393 0.677 . . . . 0.0 110.059 170.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.84 124.82 9.48 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.696 2.931 . . . . 0.0 110.319 169.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.82 144.97 45.98 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.373 -173.555 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -79.76 -164.4 0.28 Allowed 'Trans proline' 0 CA--C 1.542 0.898 1 C-N-CA 125.88 4.387 . . . . 0.0 113.045 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 68.39 71.29 0.3 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.672 2.389 . . . . 0.0 110.505 175.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -94.25 144.63 28.33 Favored Pre-proline 0 C--O 1.232 0.152 0 CA-C-N 115.378 -0.828 . . . . 0.0 113.128 -166.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.1 -28.47 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.669 2.246 . . . . 0.0 111.689 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.78 -21.14 64.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.77 0.828 . . . . 0.0 112.934 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -77.96 -16.67 57.98 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.221 -0.925 . . . . 0.0 111.71 176.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.512 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.2 t -72.79 -21.01 61.06 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.842 1.201 . . . . 0.0 110.451 -168.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.76 3.4 9.9 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 120.01 -1.681 . . . . 0.0 110.743 -177.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -121.56 29.2 7.31 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.095 2.158 . . . . 0.0 109.348 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' CD2' ' HA ' ' A' ' 20' ' ' THR . 3.8 mm? -103.09 74.1 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.905 2.082 . . . . 0.0 105.896 167.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.256 2.0 p30 -129.44 -62.54 0.97 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.353 -172.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 2.12 45.2 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.415 1.486 . . . . 0.0 110.804 171.758 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.99 162.18 29.84 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.698 1.999 . . . . 0.0 109.57 -171.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.1 m -156.08 144.12 19.75 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 118.589 -2.569 . . . . 0.0 107.701 -173.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TRP . . . . . 0.403 ' HA ' ' H ' ' A' ' 143' ' ' SER . 28.2 m95 -149.02 175.79 11.0 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 124.171 0.92 . . . . 0.0 112.192 -161.05 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 2.6 p -153.65 118.63 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 174.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.5 tp -60.41 139.12 57.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.124 -175.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 t -145.63 -2.17 0.76 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 113.274 171.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.43 157.35 42.93 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.036 1.289 . . . . 0.0 110.281 168.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TRP . . . . . 0.429 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -152.56 100.39 2.55 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 127.098 2.159 . . . . 0.0 105.829 172.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.66 142.84 27.93 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -81.99 170.94 14.99 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 164.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.26 72.36 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 123.574 0.546 . . . . 0.0 111.502 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -86.08 3.13 43.87 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.802 1.641 . . . . 0.0 112.054 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.93 1.14 57.29 Favored Glycine 0 CA--C 1.524 0.605 0 O-C-N 120.746 -1.222 . . . . 0.0 112.789 167.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.4 m -67.01 95.74 0.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 126.344 1.857 . . . . 0.0 109.407 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.77 112.4 2.01 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.958 -1.089 . . . . 0.0 109.759 165.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -71.7 149.6 45.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.378 1.071 . . . . 0.0 109.507 176.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.49 105.73 15.53 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 124.364 1.066 . . . . 0.0 109.164 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.9 m -113.51 152.26 45.19 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 125.872 1.669 . . . . 0.0 107.207 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -73.97 120.08 6.18 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 121.887 1.724 . . . . 0.0 109.034 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.24 171.11 13.61 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.216 0.606 . . . . 0.0 110.119 171.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -38.69 77.28 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 121.895 -0.503 . . . . 0.0 110.459 169.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -9.5 58.66 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -81.57 -29.69 33.31 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.864 0.866 . . . . 0.0 111.803 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.51 -80.01 0.24 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -170.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.07 85.23 58.24 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.163 1.385 . . . . 0.0 110.137 -168.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.47 152.44 75.1 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.187 1.925 . . . . 0.0 111.036 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.1 mt -78.03 101.7 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.9 177.78 6.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.225 1.375 . . . . 0.0 108.5 174.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -144.23 146.85 32.92 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 127.031 2.133 . . . . 0.0 106.966 -178.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -145.29 143.52 30.25 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 105.917 -1.882 . . . . 0.0 105.917 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.03 128.96 41.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 172.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -159.8 177.75 10.5 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -129.43 24.03 5.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.121 0.968 . . . . 0.0 112.574 -171.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.79 -31.44 11.67 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.1 p -92.95 8.05 41.42 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.123 177.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.83 -0.46 51.15 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.21 1.386 . . . . 0.0 111.908 -166.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -117.89 161.6 19.49 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 126.037 1.735 . . . . 0.0 108.622 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -75.56 63.47 1.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 124.709 1.203 . . . . 0.0 109.832 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.96 110.64 18.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 120.801 1.637 . . . . 0.0 110.187 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.66 152.5 27.09 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.668 -1.605 . . . . 0.0 107.257 159.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.5 p -141.94 -177.88 5.42 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 125.092 1.357 . . . . 0.0 107.964 161.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.16 168.39 39.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 163.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 5.7 t80 -89.75 138.35 31.56 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 160.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.5 t -118.71 71.44 0.85 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.01 -36.21 0.4 Allowed Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.975 2.226 . . . . 0.0 116.982 167.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 7.6 t -146.49 -14.26 0.44 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.199 1.399 . . . . 0.0 111.893 163.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -130.06 115.52 17.22 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -64.5 162.46 15.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.519 164.363 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -139.09 168.45 19.81 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 125.341 1.457 . . . . 0.0 109.223 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.8 ptp -152.16 172.81 15.79 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.098 2.159 . . . . 0.0 108.185 170.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.3 -143.62 7.52 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.654 -2.178 . . . . 0.0 107.654 168.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.1 m -125.26 161.23 27.4 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 119.281 1.541 . . . . 0.0 112.777 165.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -128.62 173.62 10.13 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.228 1.011 . . . . 0.0 111.847 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -154.22 139.89 17.98 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.373 1.069 . . . . 0.0 110.349 -176.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.26 120.6 42.27 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 168.45 22.74 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.535 1.534 . . . . 0.0 109.226 169.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t0 48.31 39.06 11.55 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.065 1.346 . . . . 0.0 113.713 167.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.3 13.14 48.32 Favored Glycine 0 CA--C 1.535 1.291 0 O-C-N 120.233 -1.542 . . . . 0.0 114.56 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -134.65 164.8 26.7 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 119.244 1.522 . . . . 0.0 113.01 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.0 tp -109.92 96.83 6.5 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.693 1.597 . . . . 0.0 106.812 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.3 m -87.43 162.3 17.36 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -139.3 155.92 47.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.773 1.629 . . . . 0.0 109.166 -176.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.11 -106.6 0.15 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 170.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -143.83 58.84 1.37 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.232 1.015 . . . . 0.0 108.465 -154.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.534 ' H ' ' CD2' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -60.45 153.11 23.94 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 121.142 -0.974 . . . . 0.0 112.913 -165.805 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.78 173.1 45.42 Favored Glycine 0 N--CA 1.453 -0.201 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -147.54 -117.29 0.97 Allowed Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.3 p -120.82 178.25 4.78 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.689 1.196 . . . . 0.0 110.928 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.6 mtt85 -113.43 73.51 0.82 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.274 1.03 . . . . 0.0 108.68 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtt -74.58 176.99 6.37 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.038 -1.039 . . . . 0.0 109.342 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.43 147.74 52.39 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.55 1.14 . . . . 0.0 109.679 173.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 9.9 m -136.41 -12.62 1.83 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.17 1.788 . . . . 0.0 114.211 177.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 66.03 22.11 11.22 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.856 1.663 . . . . 0.0 113.36 176.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.2 p -110.41 165.3 12.93 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 124.009 0.924 . . . . 0.0 111.191 -165.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.92 -11.46 25.6 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.533 2.155 . . . . 0.0 112.768 164.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -93.05 -9.82 60.37 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-N 118.983 0.811 . . . . 0.0 112.881 168.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.11 -53.44 9.21 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 119.19 1.495 . . . . 0.0 112.487 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -88.2 -16.18 34.0 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -167.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.99 -17.98 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.296 170.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -44.75 -55.18 5.53 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.002 1.321 . . . . 0.0 110.06 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.63 -6.14 70.6 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.002 -0.888 . . . . 0.0 113.742 -173.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -87.08 -51.79 5.8 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.835 1.817 . . . . 0.0 109.005 162.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.84 -47.62 76.91 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.799 1.24 . . . . 0.0 111.416 -171.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.98 -44.39 91.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.059 0.391 . . . . 0.0 110.388 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.44 -34.09 76.1 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.548 0.739 . . . . 0.0 111.624 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.14 59.89 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.95 0.9 . . . . 0.0 112.564 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -72.94 -8.21 54.6 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.475 1.034 . . . . 0.0 112.257 172.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 13.7 p -83.75 -5.07 59.11 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.191 -0.943 . . . . 0.0 111.768 175.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -127.33 83.33 2.16 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.064 2.146 . . . . 0.0 107.283 -169.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -122.18 59.41 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.228 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.41 -22.88 62.68 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.895 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -135.09 165.76 24.62 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.767 1.627 . . . . 0.0 111.095 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 11.2 m -159.93 170.17 21.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.757 1.623 . . . . 0.0 109.019 176.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.06 83.42 0.13 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 125.01 1.29 . . . . 0.0 110.037 168.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.4 p -81.3 151.48 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.475 1.637 . . . . 0.0 109.898 168.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -127.0 90.84 3.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.701 1.6 . . . . 0.0 107.603 175.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 35.2 ttm -77.72 73.29 4.29 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.292 1.044 . . . . 0.0 109.25 169.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -151.45 143.42 23.88 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.574 -2.009 . . . . 0.0 105.574 162.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.07 133.44 95.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 119.72 1.145 . . . . 0.0 108.732 173.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -75.49 117.76 4.96 Favored 'Cis proline' 0 N--CA 1.455 -0.781 0 CA-C-N 120.289 1.139 . . . . 0.0 110.923 -2.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -71.21 132.51 45.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -172.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -144.08 163.23 34.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.234 1.014 . . . . 0.0 108.636 173.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.0 ttp -126.44 115.45 19.62 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -86.31 148.7 25.49 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 158.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.47 155.31 45.02 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 126.147 1.779 . . . . 0.0 106.455 167.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.2 t -141.45 125.67 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -174.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.14 165.6 24.67 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.11 -30.77 38.4 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 125.985 1.714 . . . . 0.0 111.843 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.14 -37.77 69.36 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.2 1.0 . . . . 0.0 109.019 -176.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.15 13.56 4.85 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.938 1.256 . . . . 0.0 113.873 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.12 156.36 5.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.174 1.987 . . . . 0.0 110.204 174.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.8 m -126.45 97.62 5.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LEU . . . . . 0.429 ' CD1' ' HB2' ' A' ' 33' ' ' TRP . 0.4 OUTLIER -85.0 162.11 19.49 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.257 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 88.2 m -152.94 133.06 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.124 0.57 . . . . 0.0 109.565 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -126.31 156.01 41.08 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.597 1.559 . . . . 0.0 110.689 -176.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -91.62 156.85 17.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 117.12 -1.419 . . . . 0.0 107.279 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -81.82 91.94 6.59 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 122.613 2.461 . . . . 0.0 109.706 163.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' SER . . . . . 0.403 ' H ' ' HA ' ' A' ' 28' ' ' TRP . 26.6 t -81.72 90.18 6.33 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 166.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 t -91.02 1.83 56.78 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 175.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 129.752 3.221 . . . . 0.0 114.035 -174.261 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 . . . . . 0 C--O 1.236 0.353 0 CA-C-O 121.125 0.488 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -161.52 143.36 8.76 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 124.591 1.156 . . . . 0.0 108.916 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -80.95 -31.83 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.714 2.943 . . . . 0.0 111.844 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.2 56.8 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.349 1.059 . . . . 0.0 110.707 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.574 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -154.56 -41.18 0.09 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 129.69 3.196 . . . . 0.0 107.024 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -68.13 21.45 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.018 1.327 . . . . 0.0 113.766 177.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -120.34 1.48 10.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.668 2.787 . . . . 0.0 111.428 175.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mp -113.2 2.27 15.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 129.199 3.0 . . . . 0.0 109.341 175.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.5 mm? -81.51 67.71 7.57 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.628 1.571 . . . . 0.0 107.891 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.57 -48.52 0.76 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 122.975 0.51 . . . . 0.0 111.032 -173.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.12 65.75 0.92 Allowed 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.4 p -135.67 171.09 14.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.229 1.012 . . . . 0.0 109.592 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 m -156.12 148.91 24.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.335 -2.103 . . . . 0.0 107.557 -178.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -158.67 154.46 26.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -161.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -134.93 129.22 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -76.81 130.28 37.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 106.174 -1.788 . . . . 0.0 106.174 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -123.05 -16.39 7.03 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -156.58 147.29 21.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 119.423 1.01 . . . . 0.0 108.917 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -135.67 115.2 12.71 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.32 145.69 27.83 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.088 0.955 . . . . 0.0 109.453 174.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -79.45 167.07 21.31 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.918 0.487 . . . . 0.0 110.333 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.69 70.43 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.632 0.773 . . . . 0.0 112.909 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -85.39 -30.25 23.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.23 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 139.59 -0.74 2.25 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-O 118.434 -1.203 . . . . 0.0 115.065 176.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.5 m -64.79 108.64 1.8 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 120.822 2.311 . . . . 0.0 109.758 176.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.53 110.13 1.38 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.037 0.535 . . . . 0.0 109.737 165.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 42.7 mtt-85 -63.72 171.69 2.56 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.15 1.38 . . . . 0.0 110.106 173.575 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.84 127.08 43.55 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 m -129.8 155.23 80.79 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.605 0.762 . . . . 0.0 109.566 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.35 103.48 1.69 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.62 2.213 . . . . 0.0 110.257 178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.2 m -61.1 158.25 14.14 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 166.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.7 -17.13 62.67 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.172 0.989 . . . . 0.0 113.467 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -72.39 -12.07 60.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.641 0.655 . . . . 0.0 112.662 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.0 -22.04 18.8 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 -165.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.39 -9.42 8.28 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 164.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.78 76.21 3.83 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.418 1.887 . . . . 0.0 110.031 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.93 160.97 46.11 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 123.897 3.065 . . . . 0.0 111.678 -178.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -89.23 107.01 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 124.077 0.951 . . . . 0.0 109.313 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.1 p -112.39 154.33 25.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.914 1.286 . . . . 0.0 109.596 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.22 143.07 50.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 127.724 2.41 . . . . 0.0 106.627 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.2 m -137.3 128.57 27.97 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 68.0 mt -120.09 118.56 30.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 104.858 -2.275 . . . . 0.0 104.858 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -168.71 168.36 10.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -75.29 48.66 0.43 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.051 0.94 . . . . 0.0 110.636 168.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -69.93 -20.66 63.34 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 112.402 -171.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.2 p -98.21 -0.02 44.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.54 1.136 . . . . 0.0 111.459 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.44 -17.16 57.09 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.972 1.748 . . . . 0.0 111.955 -161.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -122.51 170.19 10.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.901 1.85 . . . . 0.0 110.87 -175.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -71.53 81.46 0.81 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 123.725 0.81 . . . . 0.0 109.913 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -126.32 113.4 16.88 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.86 1.264 . . . . 0.0 107.69 -170.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.64 148.63 51.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.534 169.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 p -147.19 165.67 29.31 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 125.084 1.354 . . . . 0.0 107.744 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 165.53 -174.75 41.32 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -122.66 113.98 19.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.3 m -125.57 94.41 4.13 Favored 'General case' 0 CA--C 1.516 -0.36 0 O-C-N 123.685 0.616 . . . . 0.0 110.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.0 -101.93 1.4 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 108.077 -2.009 . . . . 0.0 108.077 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -138.07 25.98 2.72 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.819 1.31 . . . . 0.0 111.187 164.325 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -140.79 128.48 21.57 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 -170.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -73.42 147.83 43.86 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.803 -0.561 . . . . 0.0 110.304 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -123.72 169.32 11.63 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 125.143 1.377 . . . . 0.0 110.373 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -161.17 169.13 22.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.953 1.701 . . . . 0.0 109.189 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.21 173.62 25.0 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.642 1.591 . . . . 0.0 110.127 166.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.5 p -79.46 165.45 23.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.275 1.038 . . . . 0.0 111.021 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.3 p90 -140.34 174.54 10.41 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.154 0.582 . . . . 0.0 111.449 172.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.73 150.82 26.61 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.612 1.565 . . . . 0.0 109.072 174.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.67 128.55 55.33 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 123.887 0.875 . . . . 0.0 108.829 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.7 ptpt -164.14 162.22 22.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.35 1.86 . . . . 0.0 109.002 173.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 52.2 22.55 1.99 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.579 2.352 . . . . 0.0 114.749 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.62 12.79 84.11 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-O 118.388 -1.229 . . . . 0.0 112.973 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -124.98 171.01 10.56 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.588 1.555 . . . . 0.0 112.47 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.583 ' O ' HG21 ' A' ' 115' ' ' ILE . 50.7 tp -109.94 100.14 9.14 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.832 1.653 . . . . 0.0 107.237 175.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 m -79.22 155.98 28.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.471 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.7 m-85 -120.36 159.13 25.67 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.44 0.696 . . . . 0.0 109.802 173.177 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.9 -155.95 30.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.7 m -63.17 95.6 0.09 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.523 1.129 . . . . 0.0 108.965 166.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 112' ' ' LEU . 19.5 mt -79.41 175.46 10.58 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 126.281 1.832 . . . . 0.0 110.571 168.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.88 177.33 33.9 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 168.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.25 -132.18 1.97 Allowed Glycine 0 CA--C 1.522 0.508 0 CA-C-O 118.234 -1.314 . . . . 0.0 110.291 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.3 p -143.78 156.2 44.42 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.147 1.779 . . . . 0.0 111.032 -173.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -103.55 61.29 0.76 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 122.146 0.974 . . . . 0.0 108.526 -163.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 18.7 mtm -71.03 172.12 9.66 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 167.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -131.73 124.81 30.52 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.544 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 6.3 m -118.16 8.39 12.35 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 117.317 -1.325 . . . . 0.0 113.067 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 25.4 ptp 44.67 41.14 4.66 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.208 1.803 . . . . 0.0 113.869 173.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.01 156.15 65.26 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.09 0.956 . . . . 0.0 109.838 -167.121 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.24 -36.92 6.47 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.211 2.608 . . . . 0.0 110.924 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.26 -3.97 89.82 Favored Glycine 0 C--O 1.219 -0.834 0 CA-C-O 117.436 -1.758 . . . . 0.0 111.289 174.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -85.47 -61.06 1.74 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-N 120.897 2.349 . . . . 0.0 111.888 170.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.99 -18.4 63.24 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -172.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -61.26 -8.01 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.976 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -44.42 -48.73 9.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 119.276 0.944 . . . . 0.0 111.073 162.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.94 -52.38 52.61 Favored Glycine 0 C--N 1.337 0.595 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.82 -43.95 97.83 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.517 0.727 . . . . 0.0 110.631 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -62.17 -48.43 80.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.29 1.036 . . . . 0.0 109.944 -173.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.0 mt -59.83 -37.21 78.57 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.312 0.505 . . . . 0.0 110.741 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -16.75 64.38 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.34 -7.17 32.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.064 1.345 . . . . 0.0 111.618 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 90' ' ' LEU . 91.0 mt -83.67 -13.39 54.25 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.181 1.355 . . . . 0.0 111.66 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -5.06 59.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.43 1.092 . . . . 0.0 113.445 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -134.33 78.58 1.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.421 1.089 . . . . 0.0 108.408 -171.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.583 HG21 ' O ' ' A' ' 85' ' ' LEU . 27.5 mm -103.71 35.6 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.081 1.352 . . . . 0.0 110.337 -172.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -23.35 67.18 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.527 -1.983 . . . . 0.0 113.605 -164.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -124.5 158.3 33.23 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.156 1.382 . . . . 0.0 109.025 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 51.6 m -155.56 124.83 6.25 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.051 -1.031 . . . . 0.0 110.943 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -101.61 131.15 10.48 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 127.311 2.386 . . . . 0.0 110.383 171.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' A' ' 19' ' ' ALA . 1.7 p -137.48 138.29 44.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 O-C-N 120.223 -1.751 . . . . 0.0 107.974 159.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.85 97.25 5.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 169.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.505 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 29.7 mtp -76.73 -5.51 48.37 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 127.06 30.29 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.578 1.551 . . . . 0.0 108.599 158.431 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.0 137.97 53.39 Favored Pre-proline 0 N--CA 1.445 -0.72 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -83.45 110.21 1.77 Allowed 'Cis proline' 0 CA--C 1.536 0.615 0 CA-C-N 120.615 1.255 . . . . 0.0 111.675 9.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 122' ' ' MET . 79.7 mt-30 -68.66 129.67 40.62 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.93 1.292 . . . . 0.0 111.374 -164.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -141.26 112.1 7.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.549 0.69 . . . . 0.0 109.449 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 56.4 ttp -75.96 157.09 33.54 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.1 112.0 5.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 121.381 -0.824 . . . . 0.0 109.596 177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 79.2 mt -86.72 156.78 19.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.1 t -142.72 137.81 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.49 167.35 10.67 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -62.08 -19.92 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.008 1.323 . . . . 0.0 113.327 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.33 -32.55 60.96 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.003 0.82 . . . . 0.0 109.865 172.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.63 0.51 20.04 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 117.84 -1.534 . . . . 0.0 113.425 -165.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.37 159.07 13.18 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.025 1.913 . . . . 0.0 108.784 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 m -138.45 141.07 39.5 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.666 1.121 . . . . 0.0 109.088 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -132.78 111.39 11.07 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 120.423 -1.423 . . . . 0.0 108.179 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.3 m -88.47 118.65 28.26 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 124.94 1.296 . . . . 0.0 110.238 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -110.25 139.77 45.09 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.891 0.876 . . . . 0.0 110.742 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.99 153.99 33.97 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 160.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -69.75 147.49 50.41 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 158.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 1.6 t -138.81 101.39 4.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 p -81.31 -5.27 57.64 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 . . . . . 0 C--O 1.254 1.301 0 CA-C-O 117.105 -1.426 . . . . 0.0 111.144 -142.178 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 . . . . . 0 CA--C 1.543 0.68 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -125.13 144.04 46.09 Favored Pre-proline 0 N--CA 1.474 0.772 0 O-C-N 121.405 -0.809 . . . . 0.0 112.621 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.06 -23.17 18.6 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.711 2.941 . . . . 0.0 111.977 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.45 -25.72 2.8 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.198 1.399 . . . . 0.0 113.729 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.72 -2.38 57.01 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.065 -1.022 . . . . 0.0 113.311 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 m -56.03 -59.04 5.48 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 119.168 0.895 . . . . 0.0 110.44 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -14.96 12.09 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.3 -5.62 58.69 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 118.714 0.688 . . . . 0.0 109.573 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.96 -11.85 61.09 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 120.844 -1.16 . . . . 0.0 112.418 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.07 -8.12 46.84 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -167.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -138.18 62.72 1.56 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.486 1.914 . . . . 0.0 106.61 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.2 p -141.34 -176.13 4.6 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 120.611 -1.306 . . . . 0.0 110.97 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 8.1 m -144.81 -60.08 0.36 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.901 176.155 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 7.1 m95 68.68 159.54 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.128 1.371 . . . . 0.0 112.217 -176.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 t -136.61 129.38 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.541 HD11 HD12 ' A' ' 138' ' ' LEU . 52.1 tp -67.75 151.18 47.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 t -144.46 -23.36 0.53 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.06 146.13 29.9 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 121.202 1.819 . . . . 0.0 110.188 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.696 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.8 t90 -135.66 110.84 8.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.8 139.19 34.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -64.68 -170.17 0.05 OUTLIER 'General case' 0 C--O 1.237 0.436 0 CA-C-N 118.729 0.695 . . . . 0.0 110.559 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.71 -28.91 65.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.276 -1.515 . . . . 0.0 113.521 174.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -81.81 -45.47 15.53 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 123.242 1.496 . . . . 0.0 111.216 -165.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 140.81 -5.1 2.5 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 128.107 2.765 . . . . 0.0 112.709 -166.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -62.32 99.91 0.16 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.818 1.309 . . . . 0.0 109.689 167.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.73 122.29 12.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 159.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.7 156.05 35.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.82 146.56 53.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 162.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.6 m -141.31 156.29 67.45 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 161.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.608 1.539 . . . . 0.0 109.307 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.08 159.44 11.74 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.52 -1.363 . . . . 0.0 108.739 163.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.776 0.43 . . . . 0.0 111.552 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -19.78 66.05 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -65.86 -16.31 63.71 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.231 0.612 . . . . 0.0 112.638 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.29 -45.77 0.88 Allowed Glycine 0 C--N 1.337 0.628 0 C-N-CA 125.518 1.533 . . . . 0.0 111.174 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 68' ' ' PHE . . . -157.39 86.7 2.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.565 -155.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.07 161.27 46.6 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.814 2.343 . . . . 0.0 111.634 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.3 mt -80.36 108.48 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 125.539 1.536 . . . . 0.0 109.05 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.2 p -91.85 169.79 10.4 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 122.178 0.989 . . . . 0.0 110.649 172.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -130.58 167.33 18.89 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 161.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 10.7 m -145.64 133.6 21.36 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 170.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.4 mt -133.0 82.15 1.98 Allowed 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 t -150.23 -154.97 0.59 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.942 1.297 . . . . 0.0 107.755 175.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.3 p -128.78 43.37 3.16 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.293 1.437 . . . . 0.0 111.993 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.8 t -57.16 -41.84 79.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.466 -1.396 . . . . 0.0 112.461 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -76.75 -31.62 57.21 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 120.415 -1.428 . . . . 0.0 110.259 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 124.19 -23.86 6.39 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 127.986 2.708 . . . . 0.0 111.243 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -82.44 165.33 20.32 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.693 1.246 . . . . 0.0 109.079 170.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -74.37 80.13 1.88 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -117.33 155.89 28.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 120.365 -1.46 . . . . 0.0 111.07 171.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.66 144.33 28.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 p -150.63 65.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 122.514 1.149 . . . . 0.0 110.23 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -103.57 -175.98 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.272 0.939 . . . . 0.0 111.394 -172.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 35.9 t80 -109.35 119.42 39.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 168.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.05 168.78 10.4 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 171.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.89 -42.73 8.0 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 -144.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 49.4 t -129.38 -5.96 4.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.596 1.198 . . . . 0.0 112.67 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -131.6 123.19 27.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.3 mtt-85 -56.98 169.77 0.49 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.088 0.555 . . . . 0.0 111.863 177.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -142.19 156.21 45.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.832 175.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -154.15 155.54 35.52 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.763 1.225 . . . . 0.0 109.206 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.75 -98.32 0.11 Allowed Glycine 0 C--O 1.228 -0.273 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 7.9 m -162.75 154.28 17.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.097 1.759 . . . . 0.0 108.017 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 7.4 p90 -139.11 167.55 21.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.462 1.028 . . . . 0.0 111.519 169.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.76 143.05 26.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.651 1.18 . . . . 0.0 108.298 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.64 116.35 28.97 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 166.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -150.99 162.06 41.55 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.811 1.245 . . . . 0.0 107.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 56.14 26.32 10.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.352 1.461 . . . . 0.0 113.612 166.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.83 21.08 65.0 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.463 -1.187 . . . . 0.0 112.814 -175.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.551 ' HA ' HG21 ' A' ' 118' ' ' THR . 16.7 pttp -135.93 166.78 22.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.389 1.594 . . . . 0.0 112.18 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.28 145.12 44.24 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 164.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -141.6 161.85 36.91 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.175 -0.953 . . . . 0.0 108.762 167.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 90.6 m-85 -130.67 164.04 25.89 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.353 0.661 . . . . 0.0 111.107 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.05 -151.68 26.89 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 125.171 1.367 . . . . 0.0 110.051 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 t -66.66 121.23 14.93 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 171.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -111.26 166.84 10.75 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.569 1.948 . . . . 0.0 110.852 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 163.86 -167.48 37.96 Favored Glycine 0 CA--C 1.523 0.574 0 O-C-N 121.774 -0.579 . . . . 0.0 111.784 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -178.86 -156.79 18.05 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 126.164 1.84 . . . . 0.0 109.209 -176.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.7 t -90.8 170.37 10.16 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.667 1.233 . . . . 0.0 108.768 160.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.2 mtm180 -118.06 85.56 2.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 164.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.1 mtm -82.2 154.45 25.44 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.41 122.79 30.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 57.4 m -123.86 -32.57 3.27 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 123.809 0.844 . . . . 0.0 111.761 -170.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 16.9 ptp 45.88 56.05 6.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.909 1.684 . . . . 0.0 111.854 -175.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.7 p -144.07 159.59 52.31 Favored Pre-proline 0 C--O 1.238 0.471 0 C-N-CA 124.079 0.952 . . . . 0.0 110.847 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.29 -29.57 13.91 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.765 2.31 . . . . 0.0 111.657 174.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.14 -7.08 84.23 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.316 -0.865 . . . . 0.0 111.102 167.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.95 -42.67 4.64 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 120.202 2.001 . . . . 0.0 111.549 173.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.66 -19.19 61.47 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 121.518 -0.989 . . . . 0.0 112.89 -172.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.6 tt -65.35 -15.86 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.516 1.126 . . . . 0.0 113.333 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.9 -50.12 19.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.736 1.214 . . . . 0.0 111.076 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.28 -19.56 71.61 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.634 -0.666 . . . . 0.0 113.228 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.3 -50.89 23.54 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.721 1.261 . . . . 0.0 108.307 169.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -63.09 -48.49 78.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.4 0.68 . . . . 0.0 110.252 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 30.3 mt -60.37 -27.74 67.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.031 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -68.2 -55.59 11.72 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.57 0.623 . . . . 0.0 109.61 171.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.89 69.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.671 1.189 . . . . 0.0 112.46 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.6 mt -65.58 -3.37 4.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.854 0.862 . . . . 0.0 113.215 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 65.9 p -102.42 11.65 37.69 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.519 1.054 . . . . 0.0 111.822 169.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -135.69 43.77 2.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.793 1.637 . . . . 0.0 110.656 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 115' ' ' ILE . 4.1 mp -79.97 91.33 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 O-C-N 119.478 -2.014 . . . . 0.0 105.72 159.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.84 -27.83 24.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 168.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.524 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -147.19 165.84 28.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.389 2.676 . . . . 0.0 114.016 -172.361 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.551 HG21 ' HA ' ' A' ' 84' ' ' LYS . 12.1 t -161.0 163.62 31.57 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.994 1.318 . . . . 0.0 108.792 -178.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.62 92.24 0.2 Allowed Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 108.394 -1.883 . . . . 0.0 108.394 172.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 93.0 t -80.73 125.22 39.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 119.412 1.606 . . . . 0.0 108.774 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.74 85.7 2.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.656 1.582 . . . . 0.0 107.933 -174.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -11.88 59.92 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.927 1.291 . . . . 0.0 113.74 -175.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.85 138.4 42.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.904 1.281 . . . . 0.0 109.01 160.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 150.87 97.55 Favored Pre-proline 0 N--CA 1.445 -0.692 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 164.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.28 119.73 4.5 Favored 'Cis proline' 0 N--CA 1.456 -0.721 0 N-CA-C 109.087 -1.159 . . . . 0.0 109.087 -12.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -62.59 132.01 50.94 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.566 0.747 . . . . 0.0 110.857 -167.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -143.1 170.9 14.85 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.182 1.393 . . . . 0.0 109.8 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 42.5 ttp -139.88 118.28 12.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.071 1.348 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -79.18 150.71 31.61 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 158.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 96.3 mt -116.78 147.78 41.77 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 153.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.524 ' HB ' ' HG3' ' A' ' 117' ' ' ARG . 58.4 t -124.76 131.07 73.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 171.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 10.9 mp -78.68 160.53 27.45 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -48.67 -36.63 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.877 -1.511 . . . . 0.0 112.38 171.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -80.49 -14.43 58.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.799 0.84 . . . . 0.0 110.27 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 109.64 0.77 30.73 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.352 0.977 . . . . 0.0 114.183 -174.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.46 153.39 35.56 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.99 1.395 . . . . 0.0 109.563 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.5 m -132.25 104.5 6.79 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.754 -0.591 . . . . 0.0 109.925 -167.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.696 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.4 mm? -104.91 150.98 24.42 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 30' ' ' LEU . 46.5 m -141.76 123.96 15.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.058 0.943 . . . . 0.0 109.716 -167.199 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 5.2 m-85 -122.41 139.49 53.78 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.69 1.596 . . . . 0.0 109.438 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.22 147.34 29.01 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.447 1.499 . . . . 0.0 108.536 168.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 101.24 6.62 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 120.671 -1.268 . . . . 0.0 109.457 168.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t -84.48 118.36 24.25 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 148.176 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.0 m -138.53 65.19 1.47 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.353 1.861 . . . . 0.0 106.462 152.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 126.853 2.061 . . . . 0.0 107.285 168.074 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.547 0.213 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -150.17 144.5 17.61 Favored Pre-proline 0 N--CA 1.435 -1.177 0 O-C-N 120.35 -1.469 . . . . 0.0 111.382 177.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.04 -41.0 10.56 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.825 2.35 . . . . 0.0 110.73 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.03 22.21 0.11 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.911 1.284 . . . . 0.0 112.289 175.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.55 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -103.08 -27.35 12.63 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 119.626 1.103 . . . . 0.0 111.832 160.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.0 m -70.91 -21.75 62.33 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.018 1.327 . . . . 0.0 112.998 -171.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -22.15 4.37 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.443 1.897 . . . . 0.0 113.445 165.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 mt -107.19 50.65 0.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.561 -171.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.3 mt -121.66 21.65 10.77 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.238 1.415 . . . . 0.0 110.27 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.39 -11.12 41.47 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.237 -0.915 . . . . 0.0 112.356 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -128.79 -6.63 5.07 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -83.06 -177.78 6.88 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.608 1.163 . . . . 0.0 112.833 -166.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -136.83 -64.87 0.57 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.056 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 66.28 162.5 0.16 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.012 1.725 . . . . 0.0 113.581 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.4 t -139.82 146.93 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -97.06 133.45 41.71 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.65 -3.76 1.85 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.61 149.81 27.03 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.925 1.239 . . . . 0.0 112.171 166.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.754 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.6 t90 -137.55 132.67 33.51 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.328 2.651 . . . . 0.0 108.154 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.33 147.15 46.06 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.124 1.769 . . . . 0.0 109.405 174.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -90.85 178.13 6.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.901 0.319 . . . . 0.0 110.301 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.52 69.35 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.966 0.506 . . . . 0.0 112.318 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -100.2 18.95 17.42 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.052 0.454 . . . . 0.0 110.793 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.6 8.83 79.74 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.018 -1.676 . . . . 0.0 112.268 170.091 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -66.41 100.98 0.69 Allowed 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 125.728 1.611 . . . . 0.0 108.181 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.4 106.11 1.64 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.457 1.026 . . . . 0.0 109.882 168.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -64.7 156.06 31.54 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.572 0.749 . . . . 0.0 110.183 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 142.46 54.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 167.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.5 m -144.23 159.52 52.06 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 125.656 1.583 . . . . 0.0 108.039 168.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -75.21 115.1 4.16 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.998 2.465 . . . . 0.0 110.435 171.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 166.83 12.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.49 1.916 . . . . 0.0 109.34 166.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.25 -52.42 65.67 Favored 'General case' 0 C--O 1.23 0.07 0 O-C-N 121.87 -0.519 . . . . 0.0 111.44 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -8.4 26.17 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.33 -15.41 50.14 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 120.892 -1.13 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.66 -81.27 0.27 Allowed Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.45 85.48 7.21 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 125.497 1.519 . . . . 0.0 107.998 -174.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -67.73 164.07 32.77 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.829 2.353 . . . . 0.0 110.443 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 70' ' ' GLY . 41.0 mt -79.85 107.03 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.3 p -113.43 129.95 56.42 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.3 tp -95.43 155.34 16.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.783 1.633 . . . . 0.0 106.598 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m -144.76 118.52 9.25 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.8 mt -117.12 85.59 2.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 -174.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.38 172.45 12.93 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.799 0.84 . . . . 0.0 110.231 -172.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.0 p -103.1 24.58 10.61 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.664 1.586 . . . . 0.0 112.873 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.94 -47.09 52.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.701 1.591 . . . . 0.0 112.616 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -74.6 3.03 8.43 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 118.995 0.816 . . . . 0.0 112.995 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.92 -27.36 20.78 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 127.388 2.423 . . . . 0.0 111.829 -171.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -120.27 152.7 37.4 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 118.316 1.058 . . . . 0.0 111.16 -172.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.1 ptp85 -65.6 96.88 0.28 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.59 154.27 49.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.242 1.017 . . . . 0.0 109.204 170.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.55 111.75 23.51 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.947 -1.871 . . . . 0.0 105.947 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.1 p -124.58 86.61 2.59 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.139 1.376 . . . . 0.0 108.354 -169.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 168.13 24.91 Favored Glycine 0 N--CA 1.469 0.873 0 O-C-N 120.994 -1.066 . . . . 0.0 111.514 -163.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.401 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 22.8 t80 -95.31 102.43 14.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 123.846 0.858 . . . . 0.0 109.752 -177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 p -93.28 99.27 11.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 119.161 0.891 . . . . 0.0 109.001 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.427 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 75.07 -70.36 1.82 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 124.497 1.046 . . . . 0.0 112.784 166.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 28.3 t -130.94 -14.27 3.51 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.858 1.263 . . . . 0.0 112.797 175.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -133.87 133.79 41.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -165.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 5.8 mtt180 -71.18 138.26 49.41 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 118.29 -1.364 . . . . 0.0 109.273 170.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -103.17 162.89 12.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.969 2.043 . . . . 0.0 109.409 168.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.96 161.61 41.97 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.752 2.021 . . . . 0.0 107.232 167.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -171.92 -108.92 0.22 Allowed Glycine 0 C--N 1.334 0.456 0 O-C-N 121.927 -0.483 . . . . 0.0 112.373 169.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.0 m -154.37 168.71 25.72 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 127.278 2.231 . . . . 0.0 106.795 166.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -142.48 171.56 13.89 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.088 0.555 . . . . 0.0 110.184 162.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -146.58 152.17 38.5 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.34 1.856 . . . . 0.0 107.868 170.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.8 128.39 45.9 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 172.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -164.23 164.36 22.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 125.732 1.613 . . . . 0.0 108.639 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.88 4.88 2.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.33 6.08 89.43 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 118.576 -1.124 . . . . 0.0 112.316 -166.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.4 pttp -123.24 168.27 12.66 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 126.34 1.856 . . . . 0.0 110.846 -173.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.64 135.45 35.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 169.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.29 131.48 55.76 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 165.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.413 ' CB ' HD11 ' A' ' 90' ' ' LEU . 98.3 m-85 -97.97 161.32 13.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.09 -147.9 16.83 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -57.59 99.99 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.532 0.733 . . . . 0.0 109.049 167.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.553 HD13 HD23 ' A' ' 112' ' ' LEU . 61.2 mt -98.24 142.8 29.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.069 1.348 . . . . 0.0 108.599 170.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.15 -177.01 48.32 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.08 -168.55 32.11 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -172.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.9 p -75.61 173.32 11.2 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.988 2.515 . . . . 0.0 112.468 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -122.02 84.2 2.22 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 126.12 1.768 . . . . 0.0 108.899 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 11.0 mtt -73.68 -174.48 1.77 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.21 1.404 . . . . 0.0 108.155 159.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -142.63 109.77 5.59 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 120.824 1.647 . . . . 0.0 111.658 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 68.2 m -93.98 -14.79 25.52 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.764 -1.112 . . . . 0.0 112.442 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp 47.34 28.12 1.01 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.973 1.709 . . . . 0.0 114.824 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -117.57 164.33 19.94 Favored Pre-proline 0 C--O 1.239 0.513 0 C-N-CA 126.432 1.893 . . . . 0.0 109.936 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.92 -14.85 26.5 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.244 1.963 . . . . 0.0 113.788 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.31 -2.26 74.01 Favored Glycine 0 C--O 1.222 -0.604 0 CA-C-O 117.675 -1.625 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.75 -58.62 1.59 Allowed Glycine 0 C--N 1.337 0.587 0 CA-C-N 119.958 1.879 . . . . 0.0 112.803 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.07 -3.59 20.6 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -173.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -65.15 -10.48 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.135 0.974 . . . . 0.0 112.317 171.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -44.61 -60.68 1.87 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.265 1.426 . . . . 0.0 110.68 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.85 -30.11 77.1 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 118.501 -1.166 . . . . 0.0 112.333 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.45 -43.91 76.04 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.306 1.553 . . . . 0.0 109.845 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.72 -49.01 74.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.999 0.92 . . . . 0.0 109.758 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.39 -36.03 75.05 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.465 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -51.95 61.99 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.191 0.996 . . . . 0.0 110.123 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.79 -30.46 68.0 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.534 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.553 HD23 HD13 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -62.45 -22.11 65.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.379 1.472 . . . . 0.0 112.527 177.191 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.0 p -73.08 -27.51 61.76 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.544 -0.722 . . . . 0.0 111.157 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -114.96 49.57 1.04 Allowed 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 126.26 1.824 . . . . 0.0 110.05 -165.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.408 HD12 HD23 ' A' ' 130' ' ' LEU . 8.5 mm -75.41 69.15 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 166.339 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.64 -32.7 60.32 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 120.818 -1.176 . . . . 0.0 109.286 177.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -133.67 160.18 38.31 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.554 1.542 . . . . 0.0 110.366 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -155.47 166.5 33.35 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.131 -0.981 . . . . 0.0 109.886 -162.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.55 76.1 0.09 OUTLIER Glycine 0 CA--C 1.531 1.069 0 CA-C-N 118.61 0.641 . . . . 0.0 113.131 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.255 5.2 p -86.17 127.17 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.173 -1.781 . . . . 0.0 110.314 171.583 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -99.58 80.71 2.4 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.367 1.467 . . . . 0.0 107.041 173.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 27.8 ttm -82.18 63.38 6.36 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.843 1.656 . . . . 0.0 110.966 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -139.32 130.01 25.98 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 165.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.45 137.16 16.69 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 168.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.61 122.06 7.12 Favored 'Cis proline' 0 CA--C 1.542 0.876 0 CA-C-N 119.419 0.828 . . . . 0.0 111.383 -6.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.7 135.77 40.38 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.376 1.07 . . . . 0.0 110.93 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -146.19 176.19 9.93 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 125.972 1.709 . . . . 0.0 108.839 165.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -141.7 134.09 28.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.076 1.75 . . . . 0.0 108.027 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -112.22 155.25 24.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 126.611 1.964 . . . . 0.0 109.329 172.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -138.78 155.39 48.22 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 127.127 2.171 . . . . 0.0 109.904 162.526 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.5 t -134.06 136.59 53.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 177.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -88.2 174.26 8.32 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 122.154 0.978 . . . . 0.0 111.287 -174.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -54.41 -39.71 67.55 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.619 1.968 . . . . 0.0 111.882 163.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -84.23 -20.81 31.64 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 126.491 1.916 . . . . 0.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 95.87 20.82 25.17 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-O 118.837 -0.98 . . . . 0.0 114.369 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.82 155.91 3.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.032 1.416 . . . . 0.0 108.729 163.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.06 110.55 11.71 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 126.037 1.735 . . . . 0.0 106.676 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.754 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -116.61 150.38 38.17 Favored 'General case' 0 CA--C 1.515 -0.366 0 O-C-N 121.451 -0.781 . . . . 0.0 109.239 -172.921 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 38.7 m -138.4 103.79 4.99 Favored 'General case' 0 C--O 1.239 0.541 0 O-C-N 124.277 0.986 . . . . 0.0 111.419 -162.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.469 ' HE1' HD11 ' A' ' 130' ' ' LEU . 96.2 m-85 -92.59 168.8 10.99 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.707 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.39 143.58 47.37 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 126.573 1.949 . . . . 0.0 107.698 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -75.76 104.02 6.12 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.539 -1.351 . . . . 0.0 108.978 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 2.6 t -99.3 115.84 30.09 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 150.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 p -128.06 1.1 5.89 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.87 1.268 . . . . 0.0 112.629 156.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 C--O 1.258 1.547 0 C-N-CA 131.239 3.815 . . . . 0.0 104.164 -167.54 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 121.788 0.804 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 156.98 45.37 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 123.698 0.799 . . . . 0.0 111.627 -176.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.89 -38.0 31.77 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.898 3.065 . . . . 0.0 112.883 176.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.8 19.61 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.449 2.3 . . . . 0.0 115.468 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.84 -8.64 1.39 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.46 1.504 . . . . 0.0 113.261 -170.27 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.537 HG23 HD12 ' A' ' 23' ' ' LEU . 5.5 m -79.53 -19.37 49.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.971 1.26 . . . . 0.0 112.801 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -57.03 -19.23 17.57 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.124 1.329 . . . . 0.0 113.702 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 3.84 51.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.72 0.691 . . . . 0.0 110.388 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.537 HD12 HG23 ' A' ' 20' ' ' THR . 32.3 mt -84.99 66.19 9.63 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.492 1.042 . . . . 0.0 110.633 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -120.48 -48.35 2.3 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 124.125 0.97 . . . . 0.0 112.502 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -127.95 57.8 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.2 p -139.98 160.89 38.9 Favored 'General case' 0 C--N 1.337 0.055 0 CA-C-O 122.084 0.945 . . . . 0.0 110.63 -173.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.524 ' H ' ' NH1' ' A' ' 142' ' ' ARG . 3.2 p -142.49 136.43 29.38 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 124.123 0.969 . . . . 0.0 109.008 -158.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 47.8 m95 -149.97 165.22 33.31 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.855 0.722 . . . . 0.0 109.901 -165.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 70.4 t -142.01 123.53 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.52 130.84 45.21 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.55 -6.08 2.54 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.552 0.533 . . . . 0.0 111.918 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.9 162.13 36.87 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.019 -1.051 . . . . 0.0 110.918 169.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -145.76 116.69 7.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.63 138.72 38.24 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 174.279 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -71.28 167.27 19.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 118.574 0.625 . . . . 0.0 109.344 167.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.4 -30.16 70.38 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.18 0.592 . . . . 0.0 112.393 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -74.86 -45.07 45.49 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.69 3.47 1.78 Allowed Glycine 0 CA--C 1.531 1.035 0 CA-C-O 119.118 -0.823 . . . . 0.0 113.792 -172.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.6 m -65.04 101.63 0.53 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.377 2.089 . . . . 0.0 108.379 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.86 108.41 0.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.028 -1.045 . . . . 0.0 109.398 165.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -66.65 161.83 22.47 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.098 0.959 . . . . 0.0 110.446 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.38 145.34 39.48 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 158.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 m -140.49 165.42 30.22 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.424 1.89 . . . . 0.0 107.561 168.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.97 127.44 13.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 CA-C-N 120.556 1.234 . . . . 0.0 110.884 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.77 162.44 16.04 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.819 1.248 . . . . 0.0 112.002 164.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.15 -36.63 61.06 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.497 -0.752 . . . . 0.0 110.443 164.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.9 -21.06 60.21 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.936 0.895 . . . . 0.0 112.957 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -70.36 -11.86 61.2 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.574 -0.704 . . . . 0.0 112.523 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.1 -1.63 38.05 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 118.437 -1.202 . . . . 0.0 113.389 175.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB1' ' HE1' ' A' ' 68' ' ' PHE . . . -169.6 83.6 0.62 Allowed Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.844 1.258 . . . . 0.0 111.064 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.6 157.09 63.27 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 121.97 1.78 . . . . 0.0 110.357 171.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 32.2 mt -87.25 111.55 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.1 p -123.37 132.29 53.93 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -169.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.1 tp -111.58 134.5 53.11 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 124.993 1.317 . . . . 0.0 108.527 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.1 m -124.14 140.65 52.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 167.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.4 mt -123.3 121.56 36.15 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.9 t -172.67 -174.26 1.12 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.2 p -113.5 36.05 3.76 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.067 1.347 . . . . 0.0 112.545 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.8 m -49.12 -14.63 0.08 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 170.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -113.07 3.12 15.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.295 1.407 . . . . 0.0 111.096 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.02 -13.23 39.13 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 119.902 1.228 . . . . 0.0 111.692 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -113.67 166.07 11.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 121.232 -1.157 . . . . 0.0 110.422 164.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -55.47 115.78 2.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.642 1.177 . . . . 0.0 110.046 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.96 168.86 19.25 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.273 1.029 . . . . 0.0 108.403 176.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.13 73.47 1.45 Allowed 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.443 1.097 . . . . 0.0 109.12 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 t -68.98 116.42 9.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.73 175.84 25.03 Favored Glycine 0 C--N 1.328 0.087 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -167.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.584 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 29.6 t80 -129.56 106.87 9.04 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.014 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.3 m -78.05 -177.14 4.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.126 0.971 . . . . 0.0 108.796 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.98 -30.5 1.75 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 126.277 1.894 . . . . 0.0 117.324 -163.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.8 OUTLIER -147.58 6.88 0.84 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 119.403 1.601 . . . . 0.0 114.502 156.282 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -134.05 122.29 22.75 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -160.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -69.12 146.78 52.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.232 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -130.58 166.15 21.23 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 126.238 1.815 . . . . 0.0 109.422 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.1 ptp -154.7 163.21 40.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.448 1.899 . . . . 0.0 108.066 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 154.41 172.04 21.9 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 46.1 p -94.6 153.74 17.7 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.156 1.382 . . . . 0.0 111.589 -170.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -108.99 166.29 10.94 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.497 0.665 . . . . 0.0 110.764 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.11 122.2 7.7 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.112 1.365 . . . . 0.0 107.862 177.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.1 mt -101.47 111.84 24.2 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.565 1.546 . . . . 0.0 107.876 -172.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -154.52 163.53 40.06 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.171 1.788 . . . . 0.0 108.807 -175.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.7 29.24 2.11 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.694 2.398 . . . . 0.0 116.953 163.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.16 11.73 71.1 Favored Glycine 0 CA--C 1.533 1.196 0 O-C-N 120.85 -1.156 . . . . 0.0 113.228 -174.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -129.6 165.65 21.32 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.737 2.415 . . . . 0.0 112.242 -170.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.89 92.07 3.63 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.5 t -86.69 167.14 14.76 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -129.44 173.56 10.44 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.413 1.085 . . . . 0.0 110.702 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -106.34 -136.75 8.46 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 127.783 2.611 . . . . 0.0 108.942 170.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.9 m -64.42 83.65 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.771 1.629 . . . . 0.0 111.546 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.0 mt -77.02 143.33 39.43 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 120.848 -1.157 . . . . 0.0 108.929 169.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.83 -176.63 46.33 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.68 -141.66 3.27 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.518 0.659 . . . . 0.0 112.347 -159.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.7 t -115.53 168.22 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 169.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -126.71 90.8 3.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 171.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtm -102.68 172.85 6.61 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.78 107.12 8.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.542 1.519 . . . . 0.0 111.796 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.7 m -79.22 -7.18 58.05 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.183 0.993 . . . . 0.0 113.544 170.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 66.51 20.79 10.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.235 1.814 . . . . 0.0 113.227 176.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 p -127.03 161.31 54.58 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.099 1.76 . . . . 0.0 110.978 -170.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -37.4 5.68 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.37 2.047 . . . . 0.0 111.034 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.49 -30.5 75.11 Favored Glycine 0 C--O 1.22 -0.753 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.361 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -60.8 8.3 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.116 1.458 . . . . 0.0 109.889 167.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -81.82 1.86 32.82 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -164.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tt -78.99 -7.73 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.195 -0.941 . . . . 0.0 110.43 166.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.46 -59.28 2.5 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.689 1.596 . . . . 0.0 111.842 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.84 87.93 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 119.155 -0.803 . . . . 0.0 111.213 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.19 84.39 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 118.267 1.034 . . . . 0.0 109.985 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -64.38 -43.76 93.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.464 -0.779 . . . . 0.0 109.942 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.3 -38.02 76.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.885 1.221 . . . . 0.0 110.011 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -19.21 65.86 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.211 1.005 . . . . 0.0 113.631 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.6 -25.16 23.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.687 0.795 . . . . 0.0 110.681 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.78 11.62 3.77 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.908 1.283 . . . . 0.0 113.126 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.86 -5.99 15.36 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 125.667 1.587 . . . . 0.0 111.306 164.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -126.31 66.66 1.22 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.684 1.194 . . . . 0.0 108.415 -172.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 115' ' ' ILE . 3.1 mp -101.31 31.56 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 120.959 -1.088 . . . . 0.0 110.592 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -54.42 -29.06 48.0 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.232 -1.542 . . . . 0.0 113.435 -168.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -125.79 163.67 22.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.449 1.5 . . . . 0.0 110.02 170.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 93.6 m -157.97 165.81 34.18 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.355 1.462 . . . . 0.0 107.104 176.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -161.88 127.42 1.72 Allowed Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 169.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.74 142.35 16.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 118.874 1.337 . . . . 0.0 108.097 171.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.86 75.58 2.39 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 172.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.9 ttm -77.25 73.52 3.83 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.8 1.24 . . . . 0.0 107.757 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.5 140.22 12.37 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 171.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.2 132.19 95.01 Favored Pre-proline 0 N--CA 1.446 -0.674 0 N-CA-C 108.031 -1.099 . . . . 0.0 108.031 173.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -78.49 120.63 7.36 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 CA-C-N 119.925 1.009 . . . . 0.0 111.647 -1.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.67 131.18 45.11 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.56 0.695 . . . . 0.0 110.981 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -146.11 164.08 33.31 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.615 1.566 . . . . 0.0 106.948 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -138.48 147.96 43.8 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 125.842 1.657 . . . . 0.0 107.26 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -130.11 141.99 50.64 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 166.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.36 161.33 14.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 160.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.0 t -136.07 121.42 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.06 170.4 11.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.236 0.541 . . . . 0.0 111.158 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 46.1 p-10 -64.52 -26.11 68.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.481 169.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.58 -37.41 62.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 119.703 1.138 . . . . 0.0 108.848 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.53 10.92 9.94 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.373 -173.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -55.65 151.02 11.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 120.332 2.066 . . . . 0.0 108.628 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.6 m -130.41 96.67 4.2 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.802 0.841 . . . . 0.0 109.065 -175.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.04 133.07 36.82 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.623 1.169 . . . . 0.0 107.867 169.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.9 m -108.65 128.62 55.01 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.438 1.095 . . . . 0.0 109.431 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.87 131.07 54.19 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.725 1.21 . . . . 0.0 109.311 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.43 148.12 26.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.823 1.249 . . . . 0.0 109.62 172.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.524 ' NH1' ' H ' ' A' ' 27' ' ' SER . 34.0 tpt85 -70.26 132.94 46.48 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.737 -1.125 . . . . 0.0 108.423 173.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -133.87 60.91 1.69 Allowed 'General case' 0 C--N 1.347 0.47 0 CA-C-N 120.338 1.426 . . . . 0.0 110.517 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 3.77 7.92 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 ttm-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.195 1.398 . . . . 0.0 112.97 -169.804 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 CA--C 1.53 0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.82 144.45 89.94 Favored Pre-proline 0 N--CA 1.469 0.502 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.917 -177.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.53 -14.74 30.73 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 123.38 2.72 . . . . 0.0 112.528 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.64 31.9 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.405 1.882 . . . . 0.0 112.169 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -131.64 -28.3 1.84 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.741 -1.225 . . . . 0.0 112.213 -174.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.5 m -67.26 -17.23 64.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.994 0.815 . . . . 0.0 110.978 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -59.47 -11.26 4.22 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.961 1.304 . . . . 0.0 114.186 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.1 mt -106.6 7.72 30.85 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.526 1.53 . . . . 0.0 111.581 -172.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.37 51.8 0.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.121 1.368 . . . . 0.0 110.816 -172.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.45 0.95 0.81 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -165.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.0 -7.95 12.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.684 0.793 . . . . 0.0 111.451 148.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 80.8 p -73.83 -176.7 2.53 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.956 0.884 . . . . 0.0 112.047 -155.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -149.52 -68.42 0.21 Allowed 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.114 -2.241 . . . . 0.0 110.61 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.6 m95 69.78 163.44 0.24 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.822 1.249 . . . . 0.0 112.841 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.4 t -143.51 119.55 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.58 136.69 57.72 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.38 -11.51 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.95 151.37 28.44 Favored 'General case' 0 CA--C 1.515 -0.392 0 O-C-N 120.415 -1.428 . . . . 0.0 109.39 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -132.34 107.46 8.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -91.72 140.7 29.46 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -68.84 163.84 23.33 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.589 0.756 . . . . 0.0 110.372 166.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.52 69.82 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.708 0.803 . . . . 0.0 112.337 171.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -77.84 -21.22 51.8 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.502 0.592 . . . . 0.0 112.091 177.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.72 6.07 23.45 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.735 1.159 . . . . 0.0 114.669 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -68.28 115.41 7.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.877 2.071 . . . . 0.0 108.592 171.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.59 107.32 4.4 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.787 -1.196 . . . . 0.0 110.423 167.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.0 mtt180 -65.6 149.28 50.34 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.716 0.806 . . . . 0.0 110.18 173.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.97 139.59 58.78 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.104 0.562 . . . . 0.0 109.724 166.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -139.12 160.86 60.72 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 127.45 2.3 . . . . 0.0 108.574 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.78 116.06 4.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.532 2.155 . . . . 0.0 110.822 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.63 168.52 17.51 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.865 0.84 . . . . 0.0 111.597 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.26 -38.91 81.27 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.826 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -87.93 15.85 6.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.292 1.437 . . . . 0.0 111.597 176.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -105.76 -27.6 11.18 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.471 161.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.93 -27.33 3.67 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 123.545 0.593 . . . . 0.0 114.364 157.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -136.34 73.04 57.73 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 125.049 1.34 . . . . 0.0 110.101 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.11 143.54 78.56 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.858 1.705 . . . . 0.0 108.118 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 83.9 mt -70.83 99.56 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 125.526 1.53 . . . . 0.0 109.27 -169.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -87.41 149.85 24.19 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 126.544 1.938 . . . . 0.0 107.778 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 21.3 tp -127.87 157.8 39.52 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.299 1.44 . . . . 0.0 107.906 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.62 108.32 4.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.42 108.85 19.88 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 169.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 t -149.68 174.69 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.04 35.22 4.82 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.079 0.952 . . . . 0.0 109.924 171.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.2 t -48.35 -52.54 21.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.112 0.965 . . . . 0.0 110.224 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.5 t -84.52 10.23 11.48 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.656 1.182 . . . . 0.0 111.778 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.85 -38.63 2.82 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 127.016 2.246 . . . . 0.0 111.476 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -73.43 150.29 41.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 173.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -72.25 98.47 2.18 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 167.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.44 152.84 45.85 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 122.438 1.113 . . . . 0.0 110.375 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.93 133.37 41.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 153.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 53.5 p -116.24 172.0 7.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 141.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.93 175.1 39.27 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -109.64 94.62 5.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.6 m -73.56 80.21 1.47 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.697 0.761 . . . . 0.0 109.643 175.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.18 -51.57 4.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 124.388 0.994 . . . . 0.0 112.695 155.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -152.48 14.18 0.57 Allowed 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.924 -0.751 . . . . 0.0 111.873 153.56 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.7 110.32 6.71 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.775 -1.203 . . . . 0.0 108.304 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 136.06 40.45 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.957 1.703 . . . . 0.0 113.981 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -112.03 168.33 9.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 126.243 1.817 . . . . 0.0 110.788 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -152.73 156.72 39.69 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.142 1.777 . . . . 0.0 107.338 166.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -170.37 -109.29 0.22 Allowed Glycine 0 CA--C 1.525 0.711 0 O-C-N 121.622 -0.674 . . . . 0.0 111.883 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.6 168.88 22.69 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.405 1.482 . . . . 0.0 107.917 174.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -152.12 169.39 22.52 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.639 1.176 . . . . 0.0 110.661 170.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.18 157.15 42.3 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.77 1.628 . . . . 0.0 109.451 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.26 138.81 47.25 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.253 1.021 . . . . 0.0 108.834 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -162.31 164.69 27.36 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.922 2.089 . . . . 0.0 108.321 167.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.5 t0 51.67 32.83 9.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 162.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.34 29.43 63.21 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.197 -0.94 . . . . 0.0 113.332 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -128.54 154.79 45.78 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 128.173 2.589 . . . . 0.0 110.93 -175.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.4 HD22 ' CE1' ' A' ' 87' ' ' PHE . 0.1 OUTLIER -114.48 99.52 7.62 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 178.62 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -100.85 153.22 19.67 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 -175.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.472 ' CE1' HD12 ' A' ' 112' ' ' LEU . 37.9 m-85 -115.52 161.68 18.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.008 0.909 . . . . 0.0 110.087 -171.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.51 -168.09 37.9 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 108.693 -1.763 . . . . 0.0 108.693 159.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.85 149.97 34.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 165.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.8 mt -126.16 171.73 10.63 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.574 1.55 . . . . 0.0 110.568 -170.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.78 175.99 37.42 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 124.034 0.826 . . . . 0.0 111.081 164.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -159.43 -115.77 0.42 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.0 t -115.12 -175.1 2.62 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 129.793 3.237 . . . . 0.0 109.872 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.2 mmt180 -141.98 56.05 1.48 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.465 1.906 . . . . 0.0 108.337 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.97 159.01 31.53 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.265 -0.897 . . . . 0.0 109.753 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.9 112.18 23.84 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.989 1.316 . . . . 0.0 110.305 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.1 m -117.49 -9.34 10.86 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -176.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 55.7 mtm 61.03 22.37 12.63 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.148 0.979 . . . . 0.0 112.844 171.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.3 p -114.18 154.43 46.24 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 126.303 1.841 . . . . 0.0 108.988 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.57 -40.95 21.31 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 120.891 1.061 . . . . 0.0 109.522 170.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -70.54 -5.62 56.25 Favored Glycine 0 C--O 1.22 -0.742 0 CA-C-O 116.824 -2.098 . . . . 0.0 113.841 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . 0.401 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -78.25 -57.88 3.3 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 120.933 2.367 . . . . 0.0 109.784 168.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.36 -15.88 63.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.05 0.94 . . . . 0.0 111.846 -167.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.53 -6.13 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.716 0.806 . . . . 0.0 111.68 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -44.26 -52.57 7.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.706 1.139 . . . . 0.0 110.44 165.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -60.77 -46.36 94.65 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 119.934 -0.37 . . . . 0.0 112.498 -173.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.47 85.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.188 0.494 . . . . 0.0 109.81 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -68.64 -47.06 67.55 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.228 -0.92 . . . . 0.0 111.016 -173.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.01 -29.32 68.4 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.763 0.71 . . . . 0.0 111.017 173.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -42.02 90.91 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.084 0.554 . . . . 0.0 111.293 171.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.35 65.22 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.651 0.78 . . . . 0.0 112.111 -173.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 87' ' ' PHE . 1.1 mm? -71.83 -12.52 61.32 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.781 169.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 12.1 p -93.78 13.96 20.79 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.547 1.521 . . . . 0.0 112.311 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -141.11 28.72 1.87 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.53 1.059 . . . . 0.0 111.804 -171.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.9 mm -71.56 80.57 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 125.441 1.497 . . . . 0.0 107.447 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -80.27 -34.67 36.84 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 165.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -125.4 164.04 21.29 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.101 0.96 . . . . 0.0 110.576 -176.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 53.7 m -160.87 145.28 13.82 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.04 91.78 0.15 Allowed Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 108.229 -1.949 . . . . 0.0 108.229 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.483 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.266 4.5 p -87.59 132.46 32.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.389 1.094 . . . . 0.0 110.091 165.746 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -98.42 88.52 4.15 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 166.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 51.8 tpp -82.67 57.48 3.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 174.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -145.08 116.51 8.04 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.27 125.48 14.97 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-O 117.297 -1.335 . . . . 0.0 109.517 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 115.2 3.41 Favored 'Cis proline' 0 CA--C 1.538 0.691 0 O-C-N 122.933 0.965 . . . . 0.0 112.706 5.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -78.82 129.71 34.89 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -167.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.67 160.29 41.44 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.443 1.497 . . . . 0.0 108.424 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 46.6 ttp -134.09 127.11 31.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -123.61 109.72 14.11 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.813 0.845 . . . . 0.0 108.737 -174.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 16.3 mt -94.04 143.49 26.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -131.85 136.29 57.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.2 mp -95.33 171.27 8.81 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.625 0.726 . . . . 0.0 110.497 -174.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -53.31 -27.47 23.3 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 112.621 168.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -90.66 -16.56 28.38 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.193 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 105.99 8.35 34.25 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.693 -1.615 . . . . 0.0 115.607 177.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.18 165.45 0.09 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 120.063 1.931 . . . . 0.0 110.842 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.3 m -142.11 95.86 2.87 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 120.243 -1.536 . . . . 0.0 109.67 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.0 mp -86.92 146.72 26.06 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.156 -0.965 . . . . 0.0 108.68 173.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.4 m -125.46 125.23 43.0 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.94 1.296 . . . . 0.0 109.038 -176.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -123.07 135.01 54.23 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.322 1.049 . . . . 0.0 110.084 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -81.54 147.51 29.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.912 1.285 . . . . 0.0 108.338 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.8 tpt85 -76.26 100.42 5.08 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.694 -1.254 . . . . 0.0 108.94 165.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 20.7 t -75.76 127.65 33.48 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 146.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -131.47 17.2 4.88 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.455 1.902 . . . . 0.0 112.853 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 . . . . . 0 C--O 1.251 1.181 0 CA-C-N 118.872 0.76 . . . . 0.0 110.065 170.145 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.2 144.27 31.87 Favored Pre-proline 0 N--CA 1.472 0.66 0 C-N-CA 124.533 1.133 . . . . 0.0 111.158 -174.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -84.8 -18.51 4.47 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 124.215 3.277 . . . . 0.0 112.577 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.81 -10.36 8.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.992 0.917 . . . . 0.0 113.022 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -101.38 -2.37 31.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.409 2.284 . . . . 0.0 112.611 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.1 m -60.69 -57.21 13.67 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.098 1.317 . . . . 0.0 111.598 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.68 -18.14 0.65 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -80.78 5.25 16.42 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.125 1.37 . . . . 0.0 111.262 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.6 61.71 3.74 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 119.546 -1.971 . . . . 0.0 111.575 -173.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.24 -52.35 1.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 118.764 0.711 . . . . 0.0 112.646 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.0 -4.79 57.24 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.919 0.781 . . . . 0.0 111.79 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.5 -177.1 2.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.487 1.115 . . . . 0.0 111.499 -173.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.3 m -142.95 -57.73 0.43 Allowed 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.082 -1.636 . . . . 0.0 112.845 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 9.0 m95 69.83 165.68 0.27 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.342 1.857 . . . . 0.0 112.293 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -143.14 137.69 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -79.5 132.06 36.22 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 175.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.3 t -126.24 -17.05 5.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.38 158.35 34.08 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.653 1.115 . . . . 0.0 111.097 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -139.06 95.04 2.88 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.737 1.615 . . . . 0.0 108.672 -176.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.95 146.16 46.25 Favored 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 121.441 -0.787 . . . . 0.0 110.439 174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 41' ' ' ARG . 28.3 mt-30 -80.23 166.49 21.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.096 1.358 . . . . 0.0 109.645 166.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.29 14.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.84 2.056 . . . . 0.0 113.497 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -137.13 4.61 2.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.154 1.782 . . . . 0.0 111.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.94 -5.0 78.93 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.357 -1.464 . . . . 0.0 112.961 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.3 m -68.94 108.41 3.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.659 1.584 . . . . 0.0 108.971 171.322 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.74 129.82 41.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.007 -1.058 . . . . 0.0 109.957 163.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 35' ' ' GLN . 28.3 mtt85 -77.86 172.69 13.08 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.827 1.651 . . . . 0.0 110.71 174.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.42 136.18 33.96 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 162.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.71 157.59 77.94 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.289 1.836 . . . . 0.0 108.486 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.86 123.9 9.72 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.753 1.635 . . . . 0.0 109.739 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -78.51 172.05 14.22 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 164.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -51.65 62.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.095 0.958 . . . . 0.0 111.911 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -67.31 -14.42 62.9 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -68.96 -15.75 63.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.749 1.159 . . . . 0.0 110.884 174.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.94 -30.76 3.65 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 123.343 0.497 . . . . 0.0 112.876 160.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.65 85.13 4.91 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -174.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -73.76 160.81 43.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.999 2.466 . . . . 0.0 112.708 -176.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.474 HG12 ' H ' ' A' ' 70' ' ' GLY . 16.5 mt -85.7 101.05 9.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.479 1.111 . . . . 0.0 108.772 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -121.54 119.16 31.14 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -79.31 164.94 23.68 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 175.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.2 m -149.82 111.71 4.57 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 119.918 -1.739 . . . . 0.0 108.34 167.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.13 147.22 29.17 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 164.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.6 t -165.4 158.22 15.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.8 p -130.88 29.36 4.74 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.567 -0.708 . . . . 0.0 110.089 167.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -53.76 -44.96 70.44 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.01 0.924 . . . . 0.0 112.018 -170.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -14.09 62.77 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.623 0.769 . . . . 0.0 112.623 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.2 2.26 55.81 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 125.497 1.522 . . . . 0.0 112.902 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.0 174.48 6.18 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.492 1.646 . . . . 0.0 108.967 164.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 26.8 mtp85 -82.21 63.07 6.23 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 125.871 1.668 . . . . 0.0 109.176 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.35 157.99 30.35 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 162.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.31 156.32 43.23 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 149.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 p -126.84 171.72 11.01 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 166.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.97 178.71 44.11 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.339 -1.504 . . . . 0.0 109.339 168.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -111.87 129.73 56.06 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 p -130.21 118.52 21.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.328 1.451 . . . . 0.0 109.3 -176.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.474 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 57.45 -78.83 0.01 OUTLIER Glycine 0 CA--C 1.526 0.778 0 C-N-CA 126.826 2.155 . . . . 0.0 112.052 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.0 OUTLIER -138.67 0.32 2.01 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 170.191 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -117.13 139.11 51.15 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 119.867 1.212 . . . . 0.0 109.587 175.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -70.75 154.93 41.39 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.57 -0.452 . . . . 0.0 109.889 161.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -138.15 164.96 27.85 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.399 1.479 . . . . 0.0 109.393 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -156.0 163.97 39.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.522 1.529 . . . . 0.0 108.469 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.56 -174.76 34.3 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 125.479 1.514 . . . . 0.0 109.331 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 p -84.14 159.57 21.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.587 0.694 . . . . 0.0 112.106 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 6.7 p90 -139.75 165.18 27.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 168.468 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.34 153.23 39.43 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.934 1.294 . . . . 0.0 110.78 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.6 mt -126.09 96.69 4.82 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 125.517 1.527 . . . . 0.0 109.62 -168.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -159.81 171.61 19.17 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -171.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 56.52 23.3 7.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.29 1.436 . . . . 0.0 113.948 171.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.46 25.18 68.39 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.048 -1.032 . . . . 0.0 111.54 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -144.87 161.63 38.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.428 1.114 . . . . 0.0 111.422 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.4 tp -78.86 157.19 28.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.8 p -148.96 159.07 44.54 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 120.553 -1.342 . . . . 0.0 108.509 164.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 95.8 m-85 -133.03 165.27 25.14 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.578 1.151 . . . . 0.0 109.211 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -102.72 -156.2 25.37 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 173.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.9 t -56.76 95.04 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.355 1.062 . . . . 0.0 110.234 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mt -84.1 156.56 22.1 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.312 2.245 . . . . 0.0 109.66 167.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -171.14 166.81 39.96 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 165.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -162.62 -174.78 32.94 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 108.305 -1.918 . . . . 0.0 108.305 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.08 173.89 7.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.644 0.735 . . . . 0.0 110.61 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -125.39 73.1 1.29 Allowed 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.276 1.431 . . . . 0.0 107.221 172.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 64.4 mtm -72.71 162.02 30.01 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.862 1.665 . . . . 0.0 109.01 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -106.55 133.43 51.25 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.286 1.034 . . . . 0.0 109.482 174.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 51.0 m -126.97 -9.35 6.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.107 0.963 . . . . 0.0 113.286 166.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.3 ptp 44.69 48.41 8.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.66 1.584 . . . . 0.0 113.123 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.3 p -135.68 156.45 77.49 Favored Pre-proline 0 C--O 1.239 0.537 0 C-N-CA 124.785 1.234 . . . . 0.0 110.372 177.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.95 -25.09 20.12 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.972 2.448 . . . . 0.0 111.85 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.95 -19.36 70.33 Favored Glycine 0 C--N 1.34 0.777 0 CA-C-O 118.439 -1.201 . . . . 0.0 111.561 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.46 -63.5 2.61 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-N 119.492 1.646 . . . . 0.0 110.326 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.42 -3.42 30.42 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -165.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.9 -18.14 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 O-C-N 121.725 -0.609 . . . . 0.0 111.673 167.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -46.53 -48.86 19.25 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.714 1.606 . . . . 0.0 111.302 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -54.34 -42.3 73.85 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.217 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.08 -37.12 61.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.989 0.895 . . . . 0.0 109.194 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.77 -44.83 96.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.192 0.597 . . . . 0.0 110.792 -174.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.72 -40.85 96.53 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.034 0.379 . . . . 0.0 109.983 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -17.66 64.66 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.58 0.752 . . . . 0.0 112.573 177.269 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.38 2.8 37.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.32 2.248 . . . . 0.0 112.281 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.0 mt -93.5 -26.89 16.97 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.116 1.325 . . . . 0.0 112.514 176.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.16 -11.04 42.3 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.794 1.179 . . . . 0.0 112.552 -178.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -96.98 106.51 18.86 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 168.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -136.02 65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 104.834 -2.284 . . . . 0.0 104.834 172.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.2 -33.76 73.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 116.276 -1.821 . . . . 0.0 109.93 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.722 ' HB2' ' CG1' ' A' ' 131' ' ' VAL . 74.5 mtt-85 -129.03 172.63 11.19 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-N 121.803 2.092 . . . . 0.0 112.981 162.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 m -150.44 150.93 31.99 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.822 1.649 . . . . 0.0 106.734 175.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -136.3 106.47 0.56 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 172.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -86.54 108.67 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 172.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 73.05 3.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 168.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttm -73.71 74.67 1.55 Allowed 'General case' 0 C--N 1.341 0.225 0 CA-C-O 122.717 1.246 . . . . 0.0 107.92 171.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -148.26 112.8 5.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 102.308 -3.219 . . . . 0.0 102.308 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.59 134.99 95.4 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-O 116.907 -1.521 . . . . 0.0 108.0 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -76.09 123.36 9.26 Favored 'Cis proline' 0 N--CA 1.451 -1.018 0 CA-C-N 120.847 1.338 . . . . 0.0 109.978 -2.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -61.72 149.57 39.32 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.297 1.046 . . . . 0.0 111.232 -173.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.54 163.69 31.34 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 126.487 1.915 . . . . 0.0 106.159 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.92 167.49 16.55 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 122.733 1.254 . . . . 0.0 109.098 173.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -148.45 135.4 20.06 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -130.59 153.77 48.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.722 ' CG1' ' HB2' ' A' ' 117' ' ' ARG . 2.6 p -138.45 158.43 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 119.854 -0.739 . . . . 0.0 111.812 175.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 136' ' ' ASP . 2.2 mp -103.64 158.22 16.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 122.5 1.143 . . . . 0.0 108.944 175.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -21.12 66.48 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 126.273 1.829 . . . . 0.0 110.841 -166.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -71.81 -35.62 70.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 128.351 2.66 . . . . 0.0 111.065 171.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 126.83 -2.97 7.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 126.485 1.993 . . . . 0.0 113.463 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.447 ' HB2' HD22 ' A' ' 132' ' ' LEU . 66.1 m-20 -68.01 110.46 3.93 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.193 -1.181 . . . . 0.0 108.363 -177.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 28.4 m -108.64 106.78 16.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.705 1.602 . . . . 0.0 109.483 -168.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.59 160.41 22.52 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.616 -1.303 . . . . 0.0 109.645 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 61.6 m -137.78 128.86 27.45 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.289 -1.507 . . . . 0.0 109.374 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -118.28 146.28 44.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.604 -175.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -88.19 151.85 22.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 166.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -66.77 135.41 53.93 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 159.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -136.49 113.97 10.92 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.756 -2.683 . . . . 0.0 103.756 158.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.9 p -126.21 12.95 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.321 1.448 . . . . 0.0 111.356 173.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 C-N-CA 123.851 0.86 . . . . 0.0 111.622 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -127.86 147.85 64.7 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 123.87 0.868 . . . . 0.0 112.423 -167.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.49 -26.41 34.33 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 124.132 3.221 . . . . 0.0 112.09 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.06 -18.7 3.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.95 1.7 . . . . 0.0 112.587 173.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -120.09 18.81 12.36 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.615 1.966 . . . . 0.0 111.016 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 84' ' ' LYS . 14.7 m -112.24 -14.2 13.38 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.307 0.958 . . . . 0.0 112.62 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -10.09 59.15 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 120.569 -1.332 . . . . 0.0 113.076 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.41 16.32 20.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.06 0.944 . . . . 0.0 109.214 -175.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.66 14.37 3.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.145 1.778 . . . . 0.0 113.75 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -76.0 -39.05 56.62 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 120.917 1.69 . . . . 0.0 112.033 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.63 -0.91 9.08 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -162.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.2 p -95.32 166.88 11.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.309 1.044 . . . . 0.0 111.642 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.7 m -144.96 149.2 34.8 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.787 1.635 . . . . 0.0 109.515 -169.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.439 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 69.1 m95 -157.93 172.88 17.66 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.781 1.232 . . . . 0.0 112.137 -150.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.8 p -157.02 119.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 177.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 138' ' ' LEU . 16.0 tp -60.71 127.86 33.75 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.53 -11.87 3.5 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 123.847 0.717 . . . . 0.0 111.527 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.52 151.28 32.43 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 119.607 1.094 . . . . 0.0 110.579 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -138.73 112.49 8.38 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.42 139.95 31.78 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 173.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -70.04 171.17 9.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 160.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.5 84.17 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.203 -0.311 . . . . 0.0 110.664 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 0.9 44.96 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.072 0.949 . . . . 0.0 111.601 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.67 -2.69 49.2 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-O 118.816 -0.991 . . . . 0.0 113.208 168.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 m -61.16 103.81 0.32 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.061 1.344 . . . . 0.0 108.818 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 119.01 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 120.779 -1.201 . . . . 0.0 109.684 169.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -73.24 155.43 39.55 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.092 0.957 . . . . 0.0 109.469 170.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.99 141.35 43.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.421 163.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -138.96 158.59 69.49 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 125.638 1.575 . . . . 0.0 108.24 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.4 109.0 1.92 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.07 1.846 . . . . 0.0 109.706 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.13 173.9 1.77 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.022 0.929 . . . . 0.0 110.5 174.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.11 12.08 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.263 -0.898 . . . . 0.0 110.37 170.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -71.61 -6.56 41.77 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -67.96 -13.45 62.18 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.867 1.212 . . . . 0.0 112.274 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 127.3 -72.66 0.46 Allowed Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.732 1.151 . . . . 0.0 112.131 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.69 85.21 21.24 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 126.101 1.761 . . . . 0.0 109.691 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.01 163.77 37.4 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.346 2.697 . . . . 0.0 112.754 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 16.3 mt -87.16 87.84 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.332 1.053 . . . . 0.0 108.741 177.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.27 130.14 54.18 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -174.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.2 tp -114.39 139.29 49.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.848 1.659 . . . . 0.0 106.942 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 m -125.81 137.73 53.79 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 168.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.5 128.47 56.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 167.573 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -169.74 177.29 4.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 40.8 p -93.27 47.74 1.28 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 109.647 164.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -61.63 -51.96 66.34 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.069 -1.02 . . . . 0.0 110.03 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.416 HG23 ' H ' ' A' ' 62' ' ' GLN . 8.7 t -71.38 -25.23 62.27 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.794 -0.566 . . . . 0.0 111.069 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.33 0.01 29.6 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.471 1.51 . . . . 0.0 113.848 -167.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.416 ' H ' HG23 ' A' ' 60' ' ' THR . 8.8 mt-30 -118.14 154.92 31.33 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.907 1.683 . . . . 0.0 108.415 166.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -76.99 78.0 3.54 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.677 1.191 . . . . 0.0 109.809 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -130.45 163.85 26.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.487 1.136 . . . . 0.0 113.939 -173.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.02 100.42 10.01 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 125.89 1.676 . . . . 0.0 106.823 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -108.33 63.69 0.61 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.592 1.187 . . . . 0.0 111.446 -177.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -110.21 169.14 13.37 Favored Glycine 0 N--CA 1.467 0.763 0 C-N-CA 125.146 1.355 . . . . 0.0 111.324 -163.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.529 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.6 t80 -95.03 129.9 41.92 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.6 t -108.16 175.09 5.6 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 163.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.84 -29.77 2.14 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 127.36 2.41 . . . . 0.0 116.639 -156.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.5 t -135.65 -27.03 1.19 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 118.757 1.278 . . . . 0.0 112.716 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.09 137.58 51.33 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.1 ptt180 -65.67 -174.74 0.23 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.82 -1.536 . . . . 0.0 110.43 170.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -149.91 168.48 23.66 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 124.103 0.961 . . . . 0.0 109.218 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -153.83 153.85 32.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 126.981 2.112 . . . . 0.0 105.965 167.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -164.59 -113.21 0.28 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.498 -1.841 . . . . 0.0 108.498 164.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.82 168.25 20.67 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 126.745 2.018 . . . . 0.0 106.951 157.458 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -118.43 -179.23 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.719 1.208 . . . . 0.0 108.848 165.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -164.41 116.88 1.32 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.332 0.969 . . . . 0.0 111.256 172.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.04 113.37 12.28 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.133 0.973 . . . . 0.0 109.203 -174.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -148.65 168.53 22.59 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.799 1.24 . . . . 0.0 108.116 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 t0 48.43 23.08 0.54 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.005 2.122 . . . . 0.0 116.064 172.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.442 ' O ' HG21 ' A' ' 118' ' ' THR . . . 67.53 20.49 71.87 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-O 117.136 -1.925 . . . . 0.0 111.976 -172.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.429 ' HA ' HG21 ' A' ' 20' ' ' THR . 0.4 OUTLIER -128.11 170.73 12.61 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 128.074 2.55 . . . . 0.0 111.572 -176.376 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.6 99.58 7.84 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -97.92 157.56 16.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -122.2 175.76 6.21 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.075 1.35 . . . . 0.0 110.379 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.25 -162.75 18.84 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 126.078 1.799 . . . . 0.0 109.483 172.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.2 t -59.01 115.13 2.94 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 163.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.03 155.78 18.39 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.889 1.275 . . . . 0.0 109.127 176.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.87 157.86 12.87 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 163.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.51 91.89 0.1 OUTLIER Glycine 0 CA--C 1.523 0.58 0 CA-C-N 119.187 1.493 . . . . 0.0 114.884 172.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 82.4 p 63.72 175.33 0.17 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 131.508 3.923 . . . . 0.0 112.004 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -137.86 53.4 1.84 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.921 1.689 . . . . 0.0 109.107 -176.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.2 mtm -61.62 170.74 1.79 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.184 0.994 . . . . 0.0 110.425 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.03 128.92 54.82 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.687 1.195 . . . . 0.0 110.414 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 74.3 m -134.28 101.47 5.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 126.446 1.898 . . . . 0.0 106.553 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 22.9 ptp -70.64 44.78 0.08 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.025 1.73 . . . . 0.0 113.22 -177.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.4 p -129.02 161.7 56.51 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 125.855 1.662 . . . . 0.0 107.801 -169.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.06 -47.53 6.36 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.165 1.91 . . . . 0.0 110.085 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.43 -1.76 66.13 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.775 -1.014 . . . . 0.0 112.361 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.95 -42.07 6.1 Favored Glycine 0 C--N 1.336 0.559 0 CA-C-N 118.849 1.324 . . . . 0.0 110.547 175.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.34 -16.34 40.3 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.213 1.006 . . . . 0.0 112.818 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.91 -15.34 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.771 0.829 . . . . 0.0 112.44 173.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -44.75 -47.51 10.78 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 125.604 1.561 . . . . 0.0 110.093 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -53.36 -47.61 61.87 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 119.579 -0.567 . . . . 0.0 111.785 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.97 74.43 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.682 0.741 . . . . 0.0 110.876 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.86 -42.71 90.06 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.7 -0.625 . . . . 0.0 110.216 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.24 -14.3 62.78 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.751 -1.218 . . . . 0.0 112.016 173.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.45 -8.32 45.01 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 169.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.92 -37.31 13.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.4 mt -72.93 -4.83 34.57 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.708 -1.245 . . . . 0.0 112.067 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 76.9 p -78.08 -8.47 58.26 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.674 1.189 . . . . 0.0 111.54 168.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -122.2 71.46 1.01 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.549 1.94 . . . . 0.0 107.633 -174.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.8 mm -107.95 66.2 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -73.8 -42.27 61.21 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 116.624 -2.03 . . . . 0.0 110.334 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -121.72 172.82 7.86 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.009 1.724 . . . . 0.0 110.578 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.442 HG21 ' O ' ' A' ' 83' ' ' GLY . 11.4 t -168.52 172.34 8.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -168.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 174.57 103.13 0.16 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 171.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 67.8 t -88.13 150.92 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 120.506 -1.585 . . . . 0.0 109.641 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.26 93.13 4.34 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.7 ttm -91.58 54.28 2.46 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 123.219 1.485 . . . . 0.0 110.052 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -135.55 126.11 26.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.245 -2.502 . . . . 0.0 104.245 170.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.82 128.6 93.81 Favored Pre-proline 0 N--CA 1.446 -0.659 0 CA-C-O 117.103 -1.427 . . . . 0.0 107.151 171.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.39 114.67 3.2 Favored 'Cis proline' 0 CA--C 1.539 0.749 0 O-C-N 123.531 1.279 . . . . 0.0 114.099 5.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.95 137.55 41.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.811 0.845 . . . . 0.0 110.778 -170.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -146.77 161.89 39.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.202 1.801 . . . . 0.0 108.0 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.33 148.66 27.78 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 171.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -129.42 133.58 47.41 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.311 0.577 . . . . 0.0 109.723 159.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.2 mt -117.65 148.5 41.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.775 1.23 . . . . 0.0 109.638 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.8 t -130.95 123.25 53.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -171.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 12.0 mt -71.64 166.93 20.87 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.64 -21.79 41.77 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.135 1.374 . . . . 0.0 111.259 173.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -80.97 -23.65 38.63 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 126.366 1.866 . . . . 0.0 111.72 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.74 -1.57 56.84 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 124.303 0.954 . . . . 0.0 113.448 -170.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.14 146.35 15.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.406 1.482 . . . . 0.0 108.623 170.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.4 m -135.56 102.84 5.24 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.63 1.172 . . . . 0.0 109.15 -163.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 30' ' ' LEU . 7.1 mp -93.5 128.05 39.44 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.402 -1.436 . . . . 0.0 109.167 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 32.2 m -107.68 131.92 53.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.533 1.133 . . . . 0.0 108.154 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -127.28 153.79 45.7 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.996 0.919 . . . . 0.0 110.625 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.587 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -86.36 156.31 20.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 117.489 -1.243 . . . . 0.0 108.553 -175.424 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -85.88 95.35 9.43 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.987 1.721 . . . . 0.0 107.453 162.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -92.0 76.33 5.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 6.4 t -82.24 13.2 3.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 115.736 -2.078 . . . . 0.0 110.897 -172.408 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 CA--C 1.538 0.482 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -84.92 144.36 41.67 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 118.231 0.469 . . . . 0.0 112.065 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.97 -23.28 30.03 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.761 2.308 . . . . 0.0 112.03 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.73 -1.73 1.46 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.405 1.882 . . . . 0.0 114.345 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.02 3.99 14.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.48 1.512 . . . . 0.0 112.004 -178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.535 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.3 t -74.86 -12.24 60.33 Favored 'General case' 0 CA--C 1.556 1.183 0 O-C-N 121.447 -0.783 . . . . 0.0 111.119 -175.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -8.37 34.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 118.992 -2.318 . . . . 0.0 112.641 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.2 mt -105.9 21.08 17.9 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.337 1.055 . . . . 0.0 112.391 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.535 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.1 mm? -110.08 62.5 0.6 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.264 1.826 . . . . 0.0 109.169 -175.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 p-10 -137.29 -41.03 0.57 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 123.689 0.796 . . . . 0.0 112.129 -163.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -136.41 16.76 3.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.354 1.073 . . . . 0.0 110.897 -177.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.7 170.24 8.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.191 2.997 . . . . 0.0 109.114 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.3 m -152.18 148.27 27.41 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 119.295 -2.128 . . . . 0.0 110.096 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 28.0 m95 -148.78 175.3 11.35 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.067 1.347 . . . . 0.0 110.221 -162.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.9 t -146.29 127.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.82 133.1 47.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 t -133.56 -9.92 2.81 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.591 ' HB3' ' HB ' ' A' ' 139' ' ' THR . . . -154.41 140.78 18.69 Favored 'General case' 0 C--N 1.339 0.143 0 O-C-N 120.629 -1.295 . . . . 0.0 109.351 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -135.28 98.76 4.05 Favored 'General case' 0 C--N 1.334 -0.106 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.82 136.61 34.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 120.447 -1.408 . . . . 0.0 107.312 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -66.97 163.83 18.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 157.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.57 84.47 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.247 0.546 . . . . 0.0 111.033 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -12.63 59.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 122.776 0.43 . . . . 0.0 110.427 -175.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 119.46 -4.59 13.38 Favored Glycine 0 C--N 1.34 0.798 0 CA-C-O 118.317 -1.268 . . . . 0.0 114.276 169.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -73.22 107.75 5.72 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.894 1.847 . . . . 0.0 108.84 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.51 110.3 1.64 Allowed 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.631 0.772 . . . . 0.0 109.89 166.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -62.0 154.42 26.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.498 1.519 . . . . 0.0 110.308 172.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.66 132.61 47.82 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 m -138.87 156.35 72.73 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 124.402 1.081 . . . . 0.0 109.876 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.15 108.69 2.21 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.45 2.1 . . . . 0.0 110.249 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 168.78 12.96 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.091 0.956 . . . . 0.0 111.033 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.26 -7.95 46.33 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.369 1.468 . . . . 0.0 112.836 170.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -118.51 9.92 12.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.304 2.242 . . . . 0.0 111.078 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -98.63 -10.35 23.44 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.298 -0.876 . . . . 0.0 112.346 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.59 -45.0 1.19 Allowed Glycine 0 C--N 1.335 0.509 0 C-N-CA 123.847 0.736 . . . . 0.0 114.312 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.87 79.53 27.33 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 127.032 2.133 . . . . 0.0 109.8 -170.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -66.22 158.41 54.97 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 123.135 2.557 . . . . 0.0 111.231 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.1 mt -90.22 113.54 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 C-N-CA 124.341 1.056 . . . . 0.0 108.229 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.9 p -119.06 140.72 49.58 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 -171.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.1 tp -125.5 140.48 52.73 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.13 1.372 . . . . 0.0 108.791 -177.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 20.7 m -134.8 129.35 34.41 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.707 1.603 . . . . 0.0 107.208 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 56' ' ' LEU . 1.8 mm? -118.75 122.95 43.66 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 178.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -168.63 -153.12 0.12 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.8 p -122.46 46.86 2.04 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.266 1.026 . . . . 0.0 112.545 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.22 -46.85 88.33 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.571 -1.331 . . . . 0.0 111.851 -173.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -77.89 1.39 20.67 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.07 -1.644 . . . . 0.0 112.342 173.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.78 -9.86 74.66 Favored Glycine 0 CA--C 1.526 0.736 0 O-C-N 120.079 -1.638 . . . . 0.0 113.119 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -104.6 160.38 14.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 119.47 1.635 . . . . 0.0 108.962 164.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -64.33 91.27 0.07 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.839 0.856 . . . . 0.0 109.604 171.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -133.74 155.28 50.04 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.603 0.716 . . . . 0.0 110.021 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.79 146.78 26.62 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.62 151.95 45.81 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 154.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.45 177.92 48.06 Favored Glycine 0 N--CA 1.445 -0.763 0 O-C-N 121.222 -0.923 . . . . 0.0 112.227 -174.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -125.13 105.57 9.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.69 1.196 . . . . 0.0 107.994 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -85.03 -1.35 56.72 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 125.083 1.353 . . . . 0.0 113.915 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 149.48 -74.71 0.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 109.374 -1.49 . . . . 0.0 109.374 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 18.0 t -151.05 14.78 0.72 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 1.157 . . . . 0.0 113.386 177.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.08 -6.01 10.47 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.081 -1.637 . . . . 0.0 112.327 172.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 52.65 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.515 1.526 . . . . 0.0 111.441 -162.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -151.72 153.28 34.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.558 167.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -145.41 161.25 40.13 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.692 1.997 . . . . 0.0 107.19 170.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.46 163.43 11.6 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 171.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 20.3 m -69.59 163.91 24.45 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.935 0.894 . . . . 0.0 111.329 -170.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -137.93 171.94 13.68 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.53 0.732 . . . . 0.0 111.598 172.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.06 150.38 31.65 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.881 1.672 . . . . 0.0 108.024 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 70.1 mt -117.63 117.36 29.17 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -164.44 168.4 18.5 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.753 1.221 . . . . 0.0 109.285 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.0 t0 48.19 23.4 0.53 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.04 77.88 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 120.085 -1.634 . . . . 0.0 113.148 -175.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' A' ' 115' ' ' ILE . 25.1 pttt -141.37 140.9 33.8 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.065 1.933 . . . . 0.0 112.164 -174.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.552 ' O ' HG21 ' A' ' 115' ' ' ILE . 14.8 tp -82.88 105.15 13.65 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.852 1.661 . . . . 0.0 108.697 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.9 m -106.88 159.05 16.55 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.789 0.804 . . . . 0.0 109.534 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.486 ' HB3' HD21 ' A' ' 90' ' ' LEU . 73.3 m-85 -115.59 -165.92 1.08 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.69 1.196 . . . . 0.0 110.435 -167.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.37 -87.77 1.7 Allowed Glycine 0 C--N 1.334 0.433 0 O-C-N 120.717 -1.24 . . . . 0.0 110.085 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.8 m -154.69 69.22 0.74 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.696 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -61.92 164.2 6.76 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 120.923 -1.111 . . . . 0.0 112.494 -173.219 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -177.3 -179.98 47.83 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 169.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.13 -158.25 7.57 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.505 1.05 . . . . 0.0 111.642 -171.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 58.7 p -88.32 178.98 6.43 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 166.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -128.28 59.16 1.52 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.306 1.412 . . . . 0.0 110.724 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.9 mtm -59.19 165.06 2.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.493 161.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.93 153.33 24.66 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -134.71 159.64 40.65 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 123.629 0.771 . . . . 0.0 109.741 169.456 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -111.61 19.54 18.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 124.818 1.247 . . . . 0.0 110.772 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.4 p -96.49 165.09 16.8 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.125 1.77 . . . . 0.0 108.133 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.77 -42.06 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.261 1.974 . . . . 0.0 109.572 165.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.47 7.31 48.25 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-O 118.319 -1.267 . . . . 0.0 112.927 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.82 -55.84 2.08 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 108.136 -1.986 . . . . 0.0 108.136 170.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -60.47 -27.03 67.23 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.871 0.868 . . . . 0.0 112.487 -174.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -63.63 -17.91 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.581 0.752 . . . . 0.0 112.3 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.04 -40.91 64.27 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 119.364 0.984 . . . . 0.0 110.404 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.57 -28.18 72.07 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.088 -0.84 . . . . 0.0 111.973 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -80.42 -45.41 17.69 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.355 1.077 . . . . 0.0 110.031 171.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.14 -46.6 86.47 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 111.115 -171.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.54 -47.46 69.97 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 118.422 0.556 . . . . 0.0 109.549 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.57 -32.49 74.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.044 0.538 . . . . 0.0 111.735 -177.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.21 -26.49 68.15 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.303 0.641 . . . . 0.0 111.357 174.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 77.4 mt -69.02 -12.11 61.39 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.997 0.817 . . . . 0.0 112.25 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.3 p -91.3 -4.57 55.74 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.327 0.967 . . . . 0.0 111.806 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -117.82 71.52 0.82 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.552 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.9 mm -107.62 83.13 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 106.201 -1.778 . . . . 0.0 106.201 172.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -95.91 -28.87 14.48 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 119.365 -0.934 . . . . 0.0 112.257 166.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -130.16 166.54 20.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 122.493 1.14 . . . . 0.0 110.303 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.9 m -162.81 170.02 18.94 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 -177.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.44 143.04 10.18 Favored Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 105.319 -3.113 . . . . 0.0 105.319 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.6 t -129.47 128.52 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 174.047 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.01 88.82 2.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 -174.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 50.39 0.61 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.854 1.788 . . . . 0.0 111.659 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.24 128.39 48.22 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.219 2.607 . . . . 0.0 104.358 170.308 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.22 136.3 80.97 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-O 117.204 -1.379 . . . . 0.0 107.684 147.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -72.67 121.89 7.01 Favored 'Cis proline' 0 N--CA 1.456 -0.703 0 CA-C-N 120.341 1.157 . . . . 0.0 110.825 -8.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.68 138.9 41.63 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.622 0.725 . . . . 0.0 110.884 -171.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -146.27 153.76 40.94 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 171.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 44.8 ttp -116.36 145.31 43.31 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.491 1.516 . . . . 0.0 107.675 176.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -133.65 102.81 5.62 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.384 0.993 . . . . 0.0 110.868 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 73.3 mt -80.62 148.88 30.08 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 66.0 t -131.72 128.47 60.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 11.2 mt -81.49 156.49 25.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.75 -36.19 35.35 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.731 1.612 . . . . 0.0 112.454 177.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.75 -6.26 58.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.075 1.35 . . . . 0.0 111.27 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.96 -4.22 14.18 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.93 1.729 . . . . 0.0 114.897 157.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.28 156.83 7.02 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 109.845 -178.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 27.2 m -140.0 97.76 3.31 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.299 -0.876 . . . . 0.0 109.548 -172.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.36 142.58 30.93 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.591 ' HB ' ' HB3' ' A' ' 32' ' ' ALA . 35.7 m -127.85 129.6 47.2 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 125.82 1.648 . . . . 0.0 107.676 -173.27 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.42 121.66 27.8 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.619 1.168 . . . . 0.0 108.714 -167.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.93 144.24 41.18 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -70.57 129.43 39.18 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 172.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 47.8 t -136.13 83.94 2.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.52 19.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.202 1.401 . . . . 0.0 112.425 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 CA-C-O 114.56 -2.638 . . . . 0.0 110.441 -167.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.9 t30 42.03 75.41 0.62 Allowed Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 127.748 2.419 . . . . 0.0 114.25 164.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -60.3 -17.72 48.44 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.178 2.585 . . . . 0.0 114.856 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.18 0.4 9.83 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.742 -1.224 . . . . 0.0 113.631 169.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.58 -26.19 54.8 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.998 1.719 . . . . 0.0 112.184 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.541 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.8 m -62.14 -30.03 70.76 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.324 1.42 . . . . 0.0 111.669 -160.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 -69.51 -20.14 63.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.039 0.936 . . . . 0.0 113.088 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.47 -7.58 59.6 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.248 1.019 . . . . 0.0 110.797 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.2 mm? -77.7 5.02 10.14 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.684 -0.635 . . . . 0.0 110.49 173.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -73.1 -20.68 60.9 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 127.433 2.293 . . . . 0.0 112.54 171.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.28 51.38 0.36 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -163.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -153.09 139.13 18.21 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.128 -1.608 . . . . 0.0 109.673 177.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 m -84.5 -64.48 1.15 Allowed 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 -166.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.408 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 15.8 m95 75.5 160.94 0.23 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.948 3.299 . . . . 0.0 115.369 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 53' ' ' THR . 6.0 p -150.19 115.54 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.033 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 138' ' ' LEU . 3.3 tm? -66.81 134.93 53.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.044 0.84 . . . . 0.0 109.456 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.519 ' N ' HD13 ' A' ' 30' ' ' LEU . 3.9 t -144.06 -2.23 0.92 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 174.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -155.12 150.86 27.6 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.462 -1.399 . . . . 0.0 111.455 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.673 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -139.2 132.12 29.36 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.758 2.023 . . . . 0.0 105.988 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.28 135.21 53.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.969 2.107 . . . . 0.0 107.36 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -78.13 170.2 17.01 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.221 0.534 . . . . 0.0 109.583 169.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.06 -15.71 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.07 3.82 44.58 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.756 1.223 . . . . 0.0 110.915 173.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.82 -7.72 81.22 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 124.559 1.076 . . . . 0.0 112.784 175.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 44.5 m -60.94 105.15 0.43 Allowed 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 126.969 2.108 . . . . 0.0 109.883 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.11 111.82 6.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.619 0.767 . . . . 0.0 109.658 170.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.07 155.02 39.77 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.656 0.783 . . . . 0.0 110.751 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.25 141.36 48.94 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 160.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.9 m -143.05 165.9 23.43 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 128.394 2.677 . . . . 0.0 105.63 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -64.42 124.66 13.68 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 CA-C-N 121.478 1.564 . . . . 0.0 108.516 168.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.77 153.86 42.38 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 123.843 0.857 . . . . 0.0 109.96 170.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.78 98.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.961 -0.462 . . . . 0.0 110.751 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.48 2.26 12.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.215 1.006 . . . . 0.0 112.052 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -84.67 -19.09 33.39 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.507 -0.759 . . . . 0.0 111.166 168.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 150.73 -84.14 0.16 Allowed Glycine 0 C--N 1.339 0.709 0 CA-C-N 119.589 1.086 . . . . 0.0 111.703 173.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -120.25 85.23 35.95 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 124.289 1.035 . . . . 0.0 109.945 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.12 175.46 3.19 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.684 2.922 . . . . 0.0 113.178 -178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.488 HG12 ' H ' ' A' ' 70' ' ' GLY . 20.5 mt -85.08 76.82 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 124.928 1.291 . . . . 0.0 109.32 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.482 ' HA ' HG23 ' A' ' 29' ' ' VAL . 0.7 OUTLIER -87.11 127.68 35.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 104.174 -2.528 . . . . 0.0 104.174 -176.319 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.2 tp -86.59 156.91 19.85 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 172.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -142.3 122.69 13.99 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 168.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 mt -117.89 114.3 23.02 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -164.58 -169.06 1.65 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.038 1.735 . . . . 0.0 108.271 177.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.9 p -130.77 27.7 4.92 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.883 -1.136 . . . . 0.0 114.023 -164.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 t -55.67 -49.02 74.03 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.157 -0.965 . . . . 0.0 112.28 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.3 t -70.5 5.71 1.7 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.773 1.17 . . . . 0.0 112.612 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.52 -5.6 73.0 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 119.765 -1.835 . . . . 0.0 113.692 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -115.49 152.51 32.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 118.976 1.388 . . . . 0.0 111.583 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 ptp85 -70.88 74.35 0.61 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.906 1.682 . . . . 0.0 110.385 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -130.51 147.61 52.22 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.199 -0.938 . . . . 0.0 110.093 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.36 155.39 24.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -158.78 98.73 1.51 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 109.127 159.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -101.25 -158.76 27.16 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 15.4 t80 -126.02 122.41 35.8 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 104.558 -2.386 . . . . 0.0 104.558 174.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.466 ' CB ' ' CZ ' ' A' ' 108' ' ' TYR . 18.7 t -117.15 100.22 7.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.886 2.13 . . . . 0.0 111.315 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.488 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 76.59 -71.99 2.03 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 125.498 1.523 . . . . 0.0 111.855 172.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.8 t -135.62 -2.1 2.46 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.094 1.358 . . . . 0.0 111.353 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.49 108.74 7.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -62.16 159.57 14.48 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 122.466 1.127 . . . . 0.0 110.954 162.438 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -139.64 174.25 10.7 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 112.117 -2.311 . . . . 0.0 108.324 -168.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -159.96 165.6 31.71 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.927 0.891 . . . . 0.0 109.862 173.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 151.96 165.22 12.9 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 124.772 1.177 . . . . 0.0 110.794 164.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 60.6 p -74.12 168.02 20.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.737 0.769 . . . . 0.0 110.778 -163.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -135.51 176.47 8.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.822 0.849 . . . . 0.0 112.304 170.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.48 149.54 30.12 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.326 1.85 . . . . 0.0 107.726 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 23' ' ' LEU . 74.5 mt -128.42 78.67 1.86 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.775 1.23 . . . . 0.0 108.419 -163.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -147.1 168.16 22.29 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.445 1.098 . . . . 0.0 109.512 -169.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.5 t70 56.81 25.07 9.89 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.043 0.937 . . . . 0.0 112.513 169.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.32 -11.39 37.83 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.084 1.802 . . . . 0.0 113.662 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -121.21 137.25 54.76 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.841 2.321 . . . . 0.0 113.311 -163.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 38.4 tp -67.81 107.21 2.53 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 167.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.5 m -100.84 164.73 11.7 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.319 1.048 . . . . 0.0 109.211 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -137.21 147.72 46.02 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.703 0.801 . . . . 0.0 110.909 -175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.01 -154.31 27.27 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.269 1.89 . . . . 0.0 110.611 171.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.5 m -64.18 98.41 0.22 Allowed 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.3 0.64 . . . . 0.0 109.733 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -84.96 166.24 16.93 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 170.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 167.83 -171.81 42.4 Favored Glycine 0 CA--C 1.53 0.987 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.46 -150.9 8.22 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 118.93 1.365 . . . . 0.0 112.854 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.2 p -85.11 171.15 12.25 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.437 1.495 . . . . 0.0 112.051 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.6 mtt180 -130.04 62.03 1.57 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.572 1.149 . . . . 0.0 110.87 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 2.7 mtt -82.04 149.39 28.11 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.171 -0.955 . . . . 0.0 108.443 175.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -90.44 140.74 29.44 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.619 0.768 . . . . 0.0 110.855 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -117.55 -21.95 8.34 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 172.218 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 68.25 19.23 9.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.753 1.221 . . . . 0.0 112.213 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 81.2 p -120.59 155.5 56.73 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 126.44 1.896 . . . . 0.0 110.784 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.2 -28.57 47.99 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.543 2.162 . . . . 0.0 111.815 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.8 -8.41 87.77 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-O 117.994 -1.448 . . . . 0.0 113.126 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.63 -47.74 9.75 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-N 119.74 1.77 . . . . 0.0 109.315 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -70.21 -24.05 63.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.072 0.936 . . . . 0.0 113.367 -167.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.9 tt -64.49 -9.1 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 O-C-N 121.679 -0.638 . . . . 0.0 112.276 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.454 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 8.3 tm-20 -61.47 -16.09 43.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.366 2.266 . . . . 0.0 111.848 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -83.71 -29.05 33.34 Favored Glycine 0 CA--C 1.525 0.672 0 O-C-N 120.079 -1.638 . . . . 0.0 112.947 170.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.65 -47.09 20.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.713 1.256 . . . . 0.0 109.621 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.802 ' CZ ' HD13 ' A' ' 109' ' ' LEU . 0.3 OUTLIER -61.09 -37.45 82.79 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 122.965 0.506 . . . . 0.0 111.524 -162.149 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.802 HD13 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -69.96 -47.28 62.93 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.571 1.948 . . . . 0.0 109.386 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -14.15 56.22 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.402 1.081 . . . . 0.0 113.062 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -94.97 -28.97 14.88 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.057 1.343 . . . . 0.0 111.502 174.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.6 mt -71.59 -8.93 57.11 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.683 -1.261 . . . . 0.0 113.194 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 9.9 p -80.56 -9.94 59.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.17 0.895 . . . . 0.0 112.338 171.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -122.35 71.05 1.0 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 125.208 1.403 . . . . 0.0 109.759 -168.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.4 mm -103.61 54.16 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -28.42 69.89 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.803 -0.56 . . . . 0.0 111.048 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -141.14 166.23 25.34 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.665 1.586 . . . . 0.0 110.266 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.2 t -160.05 161.93 34.06 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.22 83.61 0.14 Allowed Glycine 0 CA--C 1.524 0.651 0 CA-C-O 119.799 -0.445 . . . . 0.0 113.286 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.5 p -91.14 97.19 6.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.684 1.742 . . . . 0.0 111.83 170.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.72 98.63 9.78 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.493 1.117 . . . . 0.0 108.512 171.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.0 mtt -86.32 30.57 0.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.411 1.484 . . . . 0.0 114.415 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.02 89.85 3.21 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 120.292 -1.505 . . . . 0.0 110.7 -166.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -36.53 120.56 0.76 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 126.441 1.897 . . . . 0.0 112.652 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.06 126.68 9.24 Favored 'Cis proline' 0 N--CA 1.459 -0.554 0 CA-C-N 119.908 1.003 . . . . 0.0 111.724 1.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -83.84 145.04 28.87 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -140.32 179.61 6.55 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 165.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -132.93 147.65 52.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 162.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -119.04 151.12 38.81 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 126.266 1.826 . . . . 0.0 108.0 170.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.5 mt -114.44 153.44 29.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 113.541 -1.663 . . . . 0.0 106.724 155.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 41.9 t -140.49 118.98 10.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 173.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 39.5 mt -76.18 173.65 11.07 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.288 1.042 . . . . 0.0 110.933 178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -57.56 -17.62 15.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.267 1.427 . . . . 0.0 113.355 158.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -78.5 -2.44 38.66 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.38 16.96 78.75 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 124.074 0.845 . . . . 0.0 112.457 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -173.24 0.44 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.831 0.852 . . . . 0.0 112.237 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 31.4 m -148.79 125.66 11.23 Favored 'General case' 0 N--CA 1.461 0.125 0 O-C-N 119.165 -2.21 . . . . 0.0 108.189 159.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.673 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -105.48 161.2 14.55 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.094 0.958 . . . . 0.0 108.485 170.572 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 30' ' ' LEU . 42.1 m -143.08 123.33 13.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.297 0.639 . . . . 0.0 110.515 -168.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.439 ' CZ ' HD23 ' A' ' 30' ' ' LEU . 66.6 m-85 -125.88 143.6 51.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.327 1.851 . . . . 0.0 110.981 -172.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -80.45 164.9 22.68 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 119.612 1.096 . . . . 0.0 108.813 175.707 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.448 ' HE ' HG21 ' A' ' 144' ' ' THR . 6.5 tpt180 -87.62 97.72 11.02 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 156.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.7 t -109.62 52.87 0.71 Allowed 'General case' 0 C--O 1.219 -0.516 0 O-C-N 120.955 -1.09 . . . . 0.0 108.552 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' THR . . . . . 0.448 HG21 ' HE ' ' A' ' 142' ' ' ARG . 1.4 t -76.88 8.02 4.18 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.372 -0.83 . . . . 0.0 111.987 176.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 124.062 0.945 . . . . 0.0 109.732 -173.824 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.16 144.78 54.92 Favored Pre-proline 0 N--CA 1.469 0.51 0 C-N-CA 123.841 0.856 . . . . 0.0 111.202 -166.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.15 -12.0 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.175 2.583 . . . . 0.0 112.257 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.95 -2.1 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.788 -1.195 . . . . 0.0 113.002 165.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.6 21.93 10.74 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.909 2.083 . . . . 0.0 110.818 172.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.4 m -84.8 -62.55 1.52 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.945 1.248 . . . . 0.0 113.949 169.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -26.09 67.65 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.081 1.764 . . . . 0.0 115.237 -160.27 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.73 -6.11 48.96 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.838 1.655 . . . . 0.0 111.168 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.14 17.31 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.689 1.196 . . . . 0.0 111.963 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.03 -11.25 44.71 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.007 1.723 . . . . 0.0 112.054 171.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -128.11 -12.04 5.23 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.418 HG22 ' NH2' ' A' ' 142' ' ' ARG . 75.0 p -82.62 170.25 15.36 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.593 -0.692 . . . . 0.0 111.839 -172.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -144.64 148.95 34.91 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -153.14 165.63 35.05 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 125.209 1.404 . . . . 0.0 108.98 -164.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 74.3 t -143.04 120.66 6.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.75 132.77 53.34 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -139.21 -14.12 1.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.078 0.769 . . . . 0.0 113.078 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.43 43.82 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.916 1.234 . . . . 0.0 109.337 166.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -142.06 93.96 2.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 133.96 45.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 171.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -65.02 164.41 12.85 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 156.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.1 65.57 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.937 0.495 . . . . 0.0 111.992 -172.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.21 -18.43 23.47 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.327 1.051 . . . . 0.0 112.529 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 127.37 -6.05 7.16 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 115.082 0.793 . . . . 0.0 115.082 176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -69.27 103.62 2.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 119.362 1.581 . . . . 0.0 108.72 176.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 122.75 18.39 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 121.196 -0.94 . . . . 0.0 108.977 170.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.8 mtt180 -75.89 153.3 36.82 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.597 1.559 . . . . 0.0 110.312 174.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.56 125.5 26.72 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 123.775 0.83 . . . . 0.0 109.97 168.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.0 m -131.29 155.31 81.68 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 126.139 1.776 . . . . 0.0 108.028 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.49 120.88 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.568 2.178 . . . . 0.0 110.802 -178.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 168.03 8.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.346 -0.846 . . . . 0.0 111.913 164.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.28 -32.04 64.19 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 121.346 -0.846 . . . . 0.0 111.757 167.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.39 -13.3 52.61 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 121.63 -0.669 . . . . 0.0 112.517 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -75.49 -17.7 60.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.95 -22.72 5.68 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 123.735 0.683 . . . . 0.0 114.131 163.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.64 85.47 3.68 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.397 1.099 . . . . 0.0 111.087 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.84 154.26 71.38 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.93 1.753 . . . . 0.0 111.578 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.6 mt -87.48 103.22 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 127.382 2.273 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 p -123.88 135.68 53.87 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.336 -164.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -128.88 135.52 49.18 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.452 1.901 . . . . 0.0 109.432 -167.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.0 m -146.35 115.27 6.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -104.51 112.21 25.18 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.6 t -161.02 -174.5 4.41 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.3 p -93.75 35.42 1.14 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.969 0.908 . . . . 0.0 112.178 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.7 t -50.49 -55.27 16.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.856 1.207 . . . . 0.0 114.191 -161.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -94.0 8.8 40.06 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.572 1.078 . . . . 0.0 110.669 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.48 -24.51 5.25 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.199 1.381 . . . . 0.0 114.615 165.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.4 166.37 14.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 128.111 2.565 . . . . 0.0 109.288 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 3.9 ptp85 -66.94 97.01 0.46 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.71 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.5 170.86 15.0 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 123.839 1.78 . . . . 0.0 113.002 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.91 75.18 0.94 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 112.036 -2.347 . . . . 0.0 107.131 -175.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.91 86.61 4.79 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -128.68 179.49 16.58 Favored Glycine 0 CA--C 1.507 -0.415 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 -165.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -118.51 140.03 50.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.855 0.836 . . . . 0.0 109.061 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -144.99 135.1 23.93 Favored 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 128.49 2.716 . . . . 0.0 104.757 -171.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 44.14 -91.83 0.01 OUTLIER Glycine 0 CA--C 1.524 0.608 0 C-N-CA 127.514 2.483 . . . . 0.0 112.465 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.4 t -152.63 33.1 0.5 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.721 1.248 . . . . 0.0 111.572 162.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -125.03 -7.17 7.19 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 120.547 -1.346 . . . . 0.0 114.012 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 44.89 177.52 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 129.114 2.966 . . . . 0.0 113.106 -175.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -154.95 159.21 40.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.117 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.21 160.0 23.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.746 1.618 . . . . 0.0 108.61 173.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 170.82 -86.06 0.08 OUTLIER Glycine 0 CA--C 1.527 0.822 0 CA-C-O 119.479 -0.623 . . . . 0.0 112.274 163.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 p -164.56 162.21 21.56 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.585 1.954 . . . . 0.0 110.099 -178.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 37.7 p90 -143.99 171.71 13.87 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.099 0.96 . . . . 0.0 110.876 165.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -149.48 142.15 24.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 126.161 1.784 . . . . 0.0 108.617 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -102.09 93.36 5.2 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 122.179 0.99 . . . . 0.0 109.762 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -124.16 176.75 6.2 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.653 1.981 . . . . 0.0 108.695 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 52.81 14.11 0.4 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.41 2.284 . . . . 0.0 116.078 174.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 56.38 35.77 67.18 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 120.082 -1.636 . . . . 0.0 111.856 -163.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -142.66 177.31 8.39 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 127.015 2.126 . . . . 0.0 112.353 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -87.13 139.9 30.1 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.1 p -131.91 148.38 52.53 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.448 1.476 . . . . 0.0 109.948 161.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.435 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.4 m-85 -112.88 157.66 21.15 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.286 1.034 . . . . 0.0 109.79 178.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.95 -153.43 25.72 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.646 1.117 . . . . 0.0 112.047 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.37 86.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.442 1.897 . . . . 0.0 108.694 170.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.468 HD13 HD23 ' A' ' 112' ' ' LEU . 67.2 mt -79.52 173.44 12.58 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 120.995 -1.066 . . . . 0.0 111.605 -175.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 159.01 179.42 33.84 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 170.524 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.09 -109.77 0.43 Allowed Glycine 0 C--N 1.333 0.384 0 C-N-CA 125.166 1.365 . . . . 0.0 111.01 -171.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -155.61 159.49 39.67 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.796 1.638 . . . . 0.0 107.958 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -103.14 38.37 1.77 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.591 1.556 . . . . 0.0 110.371 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mtm -59.85 162.54 5.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.164 0.986 . . . . 0.0 109.549 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -107.17 144.14 34.35 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -125.49 -15.85 6.0 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 176.568 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.259 18.1 ptp 46.39 44.57 12.94 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.186 1.794 . . . . 0.0 112.419 -174.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 80.0 p -132.55 157.43 78.34 Favored Pre-proline 0 C--O 1.239 0.527 0 C-N-CA 125.417 1.487 . . . . 0.0 109.58 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.79 -27.69 21.25 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 121.533 1.488 . . . . 0.0 112.045 173.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.472 ' O ' HG22 ' A' ' 104' ' ' ILE . . . -63.9 -36.1 92.85 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 169.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.08 -35.28 91.23 Favored Glycine 0 C--N 1.335 0.519 0 CA-C-N 120.096 1.948 . . . . 0.0 113.304 -170.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -86.12 -13.56 46.81 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.036 0.918 . . . . 0.0 112.85 -175.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 101' ' ' GLY . 9.7 tt -68.31 -9.9 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 118.918 0.781 . . . . 0.0 111.22 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -44.74 -51.3 9.46 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.824 0.85 . . . . 0.0 110.899 166.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.7 -39.01 92.99 Favored Glycine 0 C--N 1.337 0.639 0 CA-C-O 119.089 -0.84 . . . . 0.0 111.381 -173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.41 -45.83 65.16 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.475 0.71 . . . . 0.0 110.256 175.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -63.64 -45.12 91.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.781 0.832 . . . . 0.0 110.91 -171.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.0 mt -62.72 -36.37 82.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.197 0.908 . . . . 0.0 109.827 173.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -17.78 64.76 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.079 1.352 . . . . 0.0 113.143 175.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.03 -33.06 12.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.776 1.23 . . . . 0.0 110.658 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.468 HD23 HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -63.85 -21.44 66.44 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.546 1.538 . . . . 0.0 112.084 176.095 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -81.64 -9.42 59.67 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.478 1.511 . . . . 0.0 112.842 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -133.46 65.66 1.58 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -175.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.0 mm -89.15 69.98 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 103.413 -2.81 . . . . 0.0 103.413 163.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -73.27 -44.94 58.4 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 118.785 -1.166 . . . . 0.0 109.044 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -122.07 168.19 12.25 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.222 1.809 . . . . 0.0 109.767 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.2 t -163.67 170.9 16.41 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.853 -1.154 . . . . 0.0 108.482 -167.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -177.65 104.25 0.19 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.232 -1.147 . . . . 0.0 110.232 175.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.3 p -113.13 142.87 24.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 O-C-N 121.144 -1.209 . . . . 0.0 109.598 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -120.75 78.91 1.43 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 125.888 1.675 . . . . 0.0 106.745 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 48.1 ttm -76.09 62.85 1.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.381 171.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -147.23 104.97 3.71 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -45.37 125.51 5.91 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.988 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.66 124.0 8.77 Favored 'Cis proline' 0 N--CA 1.459 -0.553 0 CA-C-N 119.95 1.018 . . . . 0.0 111.629 3.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -79.0 134.6 36.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -141.43 162.39 35.59 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 163.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -127.06 147.52 50.15 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 126.133 1.773 . . . . 0.0 106.247 172.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -146.18 128.06 15.41 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -171.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -114.3 151.36 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.47 -0.769 . . . . 0.0 109.122 -178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.42 117.6 47.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.3 mp -68.73 169.21 11.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.783 0.801 . . . . 0.0 110.865 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -53.57 -33.26 54.13 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.584 1.554 . . . . 0.0 112.058 172.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -84.19 -27.38 28.07 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.478 -0.764 . . . . 0.0 112.148 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.37 -5.17 10.17 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 117.856 -1.524 . . . . 0.0 115.179 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -52.33 127.46 22.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.56 1.68 . . . . 0.0 108.771 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.2 m -105.5 98.14 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.918 1.287 . . . . 0.0 109.17 -170.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.3 mp -83.21 142.62 31.03 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.496 -1.377 . . . . 0.0 108.608 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 54.4 m -123.73 132.04 53.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.492 1.117 . . . . 0.0 109.888 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -128.76 133.6 48.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.586 1.554 . . . . 0.0 109.384 -175.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.62 158.87 20.74 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.418 ' NH2' HG22 ' A' ' 26' ' ' THR . 10.9 tpt180 -84.16 133.97 34.59 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -117.23 65.92 0.73 Allowed 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 7.3 t -74.81 -1.04 20.35 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 124.464 1.105 . . . . 0.0 111.569 -167.913 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 CA--C 1.535 0.373 0 CA-C-O 122.015 0.912 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -166.11 148.25 6.14 Favored Pre-proline 0 C--O 1.238 0.454 0 O-C-N 121.161 -0.962 . . . . 0.0 108.581 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -63.26 -26.61 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.753 2.302 . . . . 0.0 111.276 173.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.13 4.11 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.529 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -99.52 -13.99 19.24 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 120.138 1.335 . . . . 0.0 111.126 165.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.46 -20.11 34.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.696 1.134 . . . . 0.0 112.883 -172.016 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -8.5 33.33 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 120.577 -1.327 . . . . 0.0 113.572 176.136 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.79 13.78 29.29 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.374 1.07 . . . . 0.0 109.867 -177.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.81 31.25 0.36 Allowed 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.007 -1.058 . . . . 0.0 110.543 177.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -85.04 -54.53 4.58 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.403 0.681 . . . . 0.0 110.044 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -118.39 2.65 11.88 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.8 1.64 . . . . 0.0 113.398 -173.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.8 p -78.97 156.33 28.53 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 123.229 1.49 . . . . 0.0 111.344 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.66 154.54 51.48 Favored 'General case' 0 N--CA 1.441 -0.925 0 O-C-N 120.332 -1.48 . . . . 0.0 109.063 -177.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.499 ' HD1' HD12 ' A' ' 54' ' ' LEU . 32.3 m95 -152.9 162.18 41.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -164.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.9 t -144.66 132.82 17.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 138' ' ' LEU . 12.0 tp -81.15 150.95 28.49 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -173.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.6 t -139.22 -23.4 0.9 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.62 161.15 43.13 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.227 -1.546 . . . . 0.0 110.224 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.615 ' CG ' HD21 ' A' ' 138' ' ' LEU . 1.3 t90 -140.31 139.28 35.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.772 1.629 . . . . 0.0 107.315 169.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.99 135.99 54.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.739 1.616 . . . . 0.0 109.683 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -69.19 160.89 30.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 109.191 163.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.01 73.64 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 111.977 172.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.89 -4.13 42.2 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.612 -0.68 . . . . 0.0 111.72 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.85 -3.05 62.37 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-O 118.26 -1.3 . . . . 0.0 112.178 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.6 m -60.67 103.95 0.3 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.053 1.427 . . . . 0.0 107.742 170.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.5 132.9 55.39 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 165.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.91 147.58 26.19 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 169.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.26 144.25 54.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 161.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -141.67 152.34 62.67 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 126.129 1.772 . . . . 0.0 106.776 170.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.08 117.29 4.62 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 121.192 1.261 . . . . 0.0 108.894 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -76.22 174.36 10.22 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.37 72.21 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.189 -0.944 . . . . 0.0 111.215 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -77.66 -7.23 56.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -79.24 -9.0 59.47 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.341 -0.849 . . . . 0.0 111.937 168.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.27 -23.7 17.8 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 118.741 -1.033 . . . . 0.0 113.179 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.02 76.7 21.73 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.632 1.173 . . . . 0.0 110.426 -168.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.87 128.21 21.43 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 122.331 2.021 . . . . 0.0 110.27 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.5 mm -60.28 96.52 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.202 1.801 . . . . 0.0 109.805 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.9 p -108.55 122.34 46.86 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.35 1.06 . . . . 0.0 108.858 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.499 HD12 ' HD1' ' A' ' 28' ' ' TRP . 1.9 tm? -109.28 140.5 42.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.72 1.608 . . . . 0.0 107.877 -177.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 m -139.61 122.78 16.91 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -92.7 136.49 33.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 156.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.7 t 174.55 -154.82 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.718 2.807 . . . . 0.0 106.044 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.3 p -123.84 42.49 3.22 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.94 1.296 . . . . 0.0 111.913 -172.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.86 -6.75 2.95 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 119.546 -1.971 . . . . 0.0 114.729 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 70.8 p -122.94 -1.41 8.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.583 1.553 . . . . 0.0 112.06 166.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.55 -7.18 74.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.372 1.463 . . . . 0.0 113.24 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -89.68 170.33 10.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.005 1.903 . . . . 0.0 109.143 170.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -69.75 86.23 0.49 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 160.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.5 141.33 47.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.849 1.66 . . . . 0.0 107.388 -171.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.7 151.37 23.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.23 132.03 22.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 162.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.76 164.92 33.87 Favored Glycine 0 C--N 1.33 0.195 0 O-C-N 121.141 -0.974 . . . . 0.0 110.924 -178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -95.5 120.52 35.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -83.12 -158.67 0.29 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.591 1.156 . . . . 0.0 108.378 166.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLY . . . . . 0.419 ' HA3' ' O ' ' A' ' 101' ' ' GLY . . . -72.36 -17.86 77.88 Favored Glycine 0 CA--C 1.526 0.748 0 O-C-N 121.082 -1.011 . . . . 0.0 114.597 -170.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 44.0 t -150.88 -41.32 0.12 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.221 0.609 . . . . 0.0 109.666 162.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -103.47 105.7 16.03 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-O 122.17 0.986 . . . . 0.0 108.855 -170.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -60.11 148.95 34.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.298 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -139.43 174.14 10.82 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 124.595 1.158 . . . . 0.0 109.104 -163.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -155.54 166.09 34.6 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.456 1.903 . . . . 0.0 108.736 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.62 166.05 20.72 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.52 1.057 . . . . 0.0 110.537 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 p -72.33 166.1 23.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 118.383 1.092 . . . . 0.0 111.306 -177.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -142.01 175.27 9.87 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.621 0.768 . . . . 0.0 110.955 171.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.78 12.31 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.518 1.927 . . . . 0.0 109.737 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.27 99.33 12.37 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.216 1.807 . . . . 0.0 106.399 168.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.26 165.14 32.79 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.563 1.145 . . . . 0.0 108.413 173.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 37.3 t70 60.34 6.24 1.0 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.595 1.958 . . . . 0.0 114.92 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.2 27.91 69.88 Favored Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.119 -1.613 . . . . 0.0 111.696 -163.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.418 ' HB2' ' CG2' ' A' ' 118' ' ' THR . 25.6 pttt -121.28 171.02 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.119 1.368 . . . . 0.0 109.089 166.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.3 tp -98.92 134.92 41.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 164.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.86 134.78 48.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 119.589 1.086 . . . . 0.0 108.538 166.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -90.41 -176.2 4.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.374 0.67 . . . . 0.0 110.362 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -120.92 -149.29 8.16 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 126.292 1.901 . . . . 0.0 109.508 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.9 t -69.66 85.98 0.47 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.5 mt -77.35 135.77 38.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.674 1.59 . . . . 0.0 109.363 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -169.32 168.88 41.59 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-O 121.638 0.577 . . . . 0.0 112.553 171.306 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.37 -168.83 13.25 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 125.1 1.333 . . . . 0.0 109.976 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.2 p -73.89 -179.05 3.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.54 1.136 . . . . 0.0 110.67 171.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -129.49 82.28 2.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.3 mtt -77.02 -175.87 3.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 167.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.84 110.69 16.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.081 0.953 . . . . 0.0 110.85 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 64.9 m -120.07 102.93 8.87 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 124.063 0.945 . . . . 0.0 108.552 164.024 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.45 57.16 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.643 2.777 . . . . 0.0 113.216 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -149.32 155.29 39.51 Favored Pre-proline 0 C--O 1.239 0.51 0 O-C-N 120.935 -1.103 . . . . 0.0 110.129 -161.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.62 -29.57 12.93 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.573 2.182 . . . . 0.0 111.126 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLY . . . . . 0.419 ' O ' ' HA3' ' A' ' 70' ' ' GLY . . . -76.11 -8.19 84.96 Favored Glycine 0 C--O 1.217 -0.945 0 CA-C-O 117.5 -1.722 . . . . 0.0 111.471 172.009 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.38 -59.12 2.07 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 120.769 2.284 . . . . 0.0 110.698 175.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.83 -12.26 60.25 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -165.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -65.15 -16.9 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 125.837 1.655 . . . . 0.0 113.335 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -45.38 -50.44 12.28 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.871 1.268 . . . . 0.0 111.319 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -56.52 -37.79 77.14 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-N 118.87 0.759 . . . . 0.0 112.179 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.25 63.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.256 1.028 . . . . 0.0 110.161 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -55.12 -48.09 74.1 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 15.0 mt -65.31 -38.73 91.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.938 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.08 -19.7 64.88 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -92.54 -43.95 8.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.734 1.214 . . . . 0.0 111.041 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.37 -18.14 60.78 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -175.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -72.63 -11.32 60.59 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.179 0.991 . . . . 0.0 113.066 174.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -124.45 56.39 1.28 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 120.333 1.424 . . . . 0.0 110.859 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.1 65.81 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.76 -31.61 59.61 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.193 -0.942 . . . . 0.0 109.997 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -124.19 162.81 22.86 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.004 1.321 . . . . 0.0 108.924 170.009 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' A' ' 84' ' ' LYS . 7.9 p -132.42 -163.7 1.37 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.081 0.952 . . . . 0.0 111.232 -162.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.8 83.5 0.04 OUTLIER Glycine 0 C--O 1.225 -0.463 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.998 156.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.2 p -97.86 151.0 4.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 119.109 1.454 . . . . 0.0 109.366 166.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.46 122.35 26.07 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 128.574 2.75 . . . . 0.0 104.474 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 4.0 ttm -114.01 42.55 2.02 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.752 2.021 . . . . 0.0 110.404 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -134.32 87.66 2.38 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.074 1.75 . . . . 0.0 107.973 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -47.72 133.79 10.93 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 125.897 1.679 . . . . 0.0 112.782 -162.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.66 122.61 7.92 Favored 'Cis proline' 0 C--N 1.346 0.441 0 CA-C-O 121.988 0.745 . . . . 0.0 113.083 4.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -82.06 126.77 32.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.346 1.058 . . . . 0.0 108.454 -174.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -141.73 149.16 40.14 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 55.5 ttp -126.98 141.57 51.76 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -170.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -112.82 150.06 32.19 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.776 ' H ' HD12 ' A' ' 130' ' ' LEU 0.272 0.1 OUTLIER -127.21 153.07 46.55 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 127.036 2.134 . . . . 0.0 105.646 155.199 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 t -141.81 122.89 12.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 103.378 -2.823 . . . . 0.0 103.378 -176.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.4 169.29 17.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.122 0.963 . . . . 0.0 110.181 -176.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.5 p-10 -52.07 -26.73 11.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.675 164.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -2.66 45.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.991 1.269 . . . . 0.0 112.734 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.28 16.06 45.2 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 0.974 . . . . 0.0 114.549 166.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.67 172.25 5.44 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.301 -1.117 . . . . 0.0 108.862 171.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.9 m -146.82 116.55 7.17 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 119.095 -2.253 . . . . 0.0 109.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.615 HD21 ' CG ' ' A' ' 33' ' ' TRP . 0.2 OUTLIER -105.16 161.16 14.5 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.646 1.178 . . . . 0.0 109.816 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 52.5 m -135.05 123.37 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.413 0.685 . . . . 0.0 110.195 -175.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -111.07 151.59 27.89 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 124.066 0.854 . . . . 0.0 111.531 165.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.59 150.4 20.75 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.843 1.257 . . . . 0.0 108.672 153.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -68.7 144.16 54.51 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 165.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.3 t -132.01 85.9 2.29 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 m -79.57 25.76 0.32 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.721 1.208 . . . . 0.0 110.67 167.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 . . . . . 0 C--O 1.247 0.952 0 C-N-CA 127.559 2.344 . . . . 0.0 110.571 -172.491 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -90.6 148.12 37.91 Favored Pre-proline 0 CA--C 1.536 0.434 0 O-C-N 120.764 -1.21 . . . . 0.0 112.624 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -65.0 -36.14 39.65 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.167 2.578 . . . . 0.0 110.498 169.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.7 21.56 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.87 2.068 . . . . 0.0 113.155 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -117.41 -18.58 9.8 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 120.177 -1.577 . . . . 0.0 111.722 169.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.3 m -72.24 -13.51 61.54 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.712 0.687 . . . . 0.0 111.89 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -79.96 2.09 24.9 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.044 1.338 . . . . 0.0 114.289 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.38 2.65 24.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.016 0.927 . . . . 0.0 110.427 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.88 -3.44 25.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.215 1.406 . . . . 0.0 111.964 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.07 -13.7 29.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 128.222 2.609 . . . . 0.0 113.531 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.66 -17.62 3.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.379 1.871 . . . . 0.0 112.582 -169.301 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.2 p -71.23 172.31 9.52 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.343 1.057 . . . . 0.0 111.281 -169.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.49 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 70.2 m -143.24 -57.82 0.41 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.325 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.5 m95 63.75 173.59 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.689 1.596 . . . . 0.0 113.982 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.1 t -142.96 127.45 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 175.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 138' ' ' LEU . 36.2 tp -70.76 138.13 50.21 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -144.3 -20.71 0.55 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.88 155.63 49.54 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 120.595 1.543 . . . . 0.0 109.369 162.301 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -136.25 96.47 3.38 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 104.695 -2.335 . . . . 0.0 104.695 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -100.65 159.03 15.5 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 173.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -104.42 168.14 9.28 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 -174.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.15 -11.76 0.3 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.05 -3.33 12.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.63 1.104 . . . . 0.0 112.704 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.37 8.13 44.49 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 118.394 -1.226 . . . . 0.0 112.204 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.3 m -73.58 99.27 3.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.77 1.785 . . . . 0.0 109.025 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.67 110.92 2.18 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 163.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.9 mtt-85 -65.05 164.32 13.12 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.064 0.935 . . . . 0.0 108.936 169.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.63 144.04 28.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.049 165.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -146.17 163.05 32.43 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.038 2.135 . . . . 0.0 109.61 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.97 115.56 4.36 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 121.682 1.588 . . . . 0.0 109.825 170.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.69 172.77 10.83 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 122.957 0.503 . . . . 0.0 109.876 165.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.05 -44.67 79.06 Favored 'General case' 0 N--CA 1.462 0.168 0 O-C-N 121.61 -0.681 . . . . 0.0 109.943 172.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -65.38 -12.58 53.52 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -76.74 -5.07 46.57 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.579 -1.325 . . . . 0.0 113.095 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.72 -42.94 1.77 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 123.446 0.546 . . . . 0.0 112.407 167.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.89 82.74 63.32 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 125.286 1.435 . . . . 0.0 108.642 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.46 171.63 16.68 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 124.285 3.323 . . . . 0.0 111.452 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.9 mt -93.45 106.55 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 123.866 0.866 . . . . 0.0 109.594 176.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 p -81.59 162.46 23.12 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 166.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.21 163.71 26.11 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -154.89 129.26 9.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.507 -1.371 . . . . 0.0 109.54 178.017 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -135.1 66.2 1.53 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.272 1.429 . . . . 0.0 110.511 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -124.55 -172.86 2.65 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.134 0.974 . . . . 0.0 109.352 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.4 p -106.22 52.91 0.71 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.795 0.838 . . . . 0.0 110.31 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t -67.22 -21.5 65.75 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.984 -1.073 . . . . 0.0 112.76 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -96.4 1.59 51.86 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.404 1.456 . . . . 0.0 111.035 169.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.48 -1.04 10.11 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 126.146 1.831 . . . . 0.0 113.034 -167.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -99.47 172.34 7.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.889 1.844 . . . . 0.0 108.191 151.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -86.79 86.03 7.31 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 125.795 1.638 . . . . 0.0 107.078 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -120.02 106.54 12.11 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.331 1.452 . . . . 0.0 111.358 -162.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 143.69 44.63 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.922 2.089 . . . . 0.0 108.847 172.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.91 176.71 10.84 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 125.499 1.52 . . . . 0.0 108.384 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.68 163.49 20.52 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 73.6 t80 -89.46 109.84 20.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 162.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.5 t -85.62 172.62 10.76 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.396 0.998 . . . . 0.0 108.569 165.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.66 -40.15 6.37 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 126.499 2.0 . . . . 0.0 116.225 -155.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.4 t -116.62 -29.5 6.09 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.171 -0.605 . . . . 0.0 112.048 169.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -131.32 125.0 31.61 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.346 1.07 . . . . 0.0 108.468 -164.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -62.75 151.66 37.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.409 165.323 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -140.39 174.48 10.47 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.571 1.548 . . . . 0.0 109.131 -175.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.4 ptp -154.76 166.28 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 126.079 1.752 . . . . 0.0 109.684 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 167.0 -178.82 41.08 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.184 1.373 . . . . 0.0 111.151 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.6 p -108.86 120.09 41.48 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.951 -1.323 . . . . 0.0 110.963 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.2 p90 -88.94 -173.37 4.06 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -167.18 129.85 1.72 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.751 1.16 . . . . 0.0 109.723 166.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.0 139.28 34.63 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.621 0.646 . . . . 0.0 109.362 172.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 8.3 ptpt -168.94 157.72 8.22 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.409 1.884 . . . . 0.0 109.057 172.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 51.72 41.35 28.98 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.776 1.63 . . . . 0.0 113.735 170.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.11 1.98 11.86 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 120.145 -1.597 . . . . 0.0 114.09 -175.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -123.3 175.86 6.46 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 119.501 1.65 . . . . 0.0 110.731 -176.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 16.7 tp -114.82 124.79 52.64 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.9 p -107.44 153.52 22.69 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -121.31 153.51 37.62 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 125.486 1.515 . . . . 0.0 108.967 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -81.62 -175.43 50.27 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.064 0.84 . . . . 0.0 112.324 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -65.1 105.28 1.03 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 163.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 69.0 mt -88.94 166.71 13.75 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.594 0.757 . . . . 0.0 109.477 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.48 48.0 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.076 163.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -164.06 -121.06 0.55 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 76.6 p -128.15 -174.32 3.18 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.936 1.294 . . . . 0.0 109.944 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.3 mmm180 -130.46 45.46 2.81 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.224 1.81 . . . . 0.0 110.133 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.7 mtm -59.4 155.12 15.42 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.86 128.72 42.99 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 118.047 0.385 . . . . 0.0 111.053 -171.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 58.4 m -134.97 108.66 7.98 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 164.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 8.7 ptp -72.13 68.33 0.71 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 161.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 48.1 p -139.6 153.1 70.02 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.621 1.568 . . . . 0.0 108.394 173.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.88 -29.39 6.94 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.146 1.897 . . . . 0.0 110.561 174.507 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -72.9 -1.53 55.54 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-O 118.019 -1.434 . . . . 0.0 112.664 166.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -86.21 -58.53 1.96 Allowed Glycine 0 C--N 1.336 0.552 0 CA-C-N 119.552 1.676 . . . . 0.0 109.526 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.64 -10.19 43.49 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -167.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 tt -68.58 -15.5 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 O-C-N 121.32 -0.863 . . . . 0.0 111.935 174.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -44.83 -56.79 4.21 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.651 1.58 . . . . 0.0 110.959 173.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.6 -38.31 96.07 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-O 119.522 -0.599 . . . . 0.0 112.045 -177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.93 -41.77 82.03 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 117.696 0.748 . . . . 0.0 110.57 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -58.67 -51.7 68.81 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.231 1.013 . . . . 0.0 110.136 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.42 -42.61 78.3 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -11.02 60.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.76 -23.64 13.78 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 125.23 1.412 . . . . 0.0 111.049 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.88 64.49 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 120.025 1.284 . . . . 0.0 110.772 166.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 42.5 p -73.3 -1.31 17.47 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.17 -0.956 . . . . 0.0 111.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 -132.48 86.31 2.31 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.745 2.018 . . . . 0.0 106.854 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.9 mm -115.86 88.44 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 102.942 -2.984 . . . . 0.0 102.942 167.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -74.06 -42.11 60.7 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.469 -1.292 . . . . 0.0 108.796 169.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 -127.22 173.59 9.61 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.097 0.559 . . . . 0.0 110.98 -175.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 16.0 m -155.29 162.93 40.75 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 119.963 -1.71 . . . . 0.0 108.739 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.54 92.19 0.1 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 125.267 1.413 . . . . 0.0 109.737 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -90.87 135.64 26.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 118.195 0.998 . . . . 0.0 109.345 171.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -106.59 99.0 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 168.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 13.23 1.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.961 1.304 . . . . 0.0 112.697 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.81 132.12 54.44 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 126.782 2.033 . . . . 0.0 107.806 -175.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.91 124.45 58.3 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.273 1.429 . . . . 0.0 110.155 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.25 111.81 2.31 Favored 'Cis proline' 0 N--CA 1.457 -0.674 0 CA-C-N 120.364 1.166 . . . . 0.0 111.055 4.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -70.04 122.07 18.67 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -171.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -136.89 162.19 33.93 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.6 ttp -124.13 136.45 54.22 Favored 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 105.029 -2.211 . . . . 0.0 105.029 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -122.6 132.25 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 58.6 mt -136.55 153.65 50.93 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-O 122.884 1.326 . . . . 0.0 109.133 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.8 m -147.2 161.29 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.399 -3.001 0 CA-C-N 110.324 -3.126 . . . . 0.0 107.594 -160.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 8.4 mp -109.17 -174.58 2.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.494 -1.684 . . . . 0.0 107.56 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.73 -40.74 84.65 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 111.968 171.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -76.51 -20.63 56.73 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.495 0.589 . . . . 0.0 111.136 171.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.98 51.37 6.29 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 124.811 1.196 . . . . 0.0 112.826 -172.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -49.93 171.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 117.916 0.858 . . . . 0.0 109.704 149.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 52.4 m -150.21 92.37 1.87 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 119.601 -1.937 . . . . 0.0 109.685 -163.253 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.578 HD23 HD11 ' A' ' 30' ' ' LEU . 3.6 mp -100.02 113.38 25.93 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.893 0.877 . . . . 0.0 109.878 -173.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.5 m -77.1 128.15 33.92 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 173.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -124.38 132.23 53.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 164.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -84.21 137.72 33.34 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.211 1.404 . . . . 0.0 108.255 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 132.15 51.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.735 1.152 . . . . 0.0 108.016 173.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' SER . . . . . 0.403 ' C ' ' H ' ' A' ' 145' ' ' ARG . 0.4 OUTLIER -141.38 68.98 1.33 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.917 1.341 . . . . 0.0 107.917 170.83 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 52.3 m -87.31 38.82 0.84 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.759 1.624 . . . . 0.0 106.844 159.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 143' ' ' SER . 47.2 mtt180 . . . . . 0 C--O 1.247 0.96 1 C-N-CA 132.508 4.323 . . . . 0.0 105.063 175.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 122.391 1.091 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -134.79 143.91 48.37 Favored Pre-proline 0 N--CA 1.435 -1.207 0 C-N-CA 124.805 1.242 . . . . 0.0 108.615 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -70.29 -23.75 28.01 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 122.385 2.057 . . . . 0.0 110.67 166.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.45 14.07 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.841 2.057 . . . . 0.0 113.812 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.588 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -123.65 -12.22 7.68 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.121 2.168 . . . . 0.0 112.286 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.499 HG21 ' C ' ' A' ' 84' ' ' LYS . 3.4 m -82.7 -16.21 48.99 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 119.151 0.887 . . . . 0.0 112.384 -174.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.08 -0.72 22.85 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.82 -1.175 . . . . 0.0 114.141 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.2 3.11 51.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.291 0.636 . . . . 0.0 110.773 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.48 32.78 0.16 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.678 1.991 . . . . 0.0 112.511 -171.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -94.07 -35.35 12.61 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.612 -1.305 . . . . 0.0 111.467 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -141.16 19.86 2.26 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 123.077 1.417 . . . . 0.0 109.868 -165.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.1 p -84.64 -170.58 3.19 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.887 -1.133 . . . . 0.0 108.268 167.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -152.37 -61.46 0.16 Allowed 'General case' 0 CA--C 1.506 -0.712 0 O-C-N 119.326 -2.109 . . . . 0.0 111.642 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 m95 65.9 159.46 0.12 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.81 1.767 . . . . 0.0 115.23 176.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.3 t -135.22 125.05 43.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 128.287 2.635 . . . . 0.0 107.845 174.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.62 126.5 27.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 170.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -126.85 -19.51 4.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 118.887 0.767 . . . . 0.0 112.085 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.08 156.4 43.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.974 -1.079 . . . . 0.0 110.635 163.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -132.1 100.27 4.99 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.95 139.14 33.52 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -80.93 170.59 16.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.73 0.812 . . . . 0.0 109.953 166.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.69 -35.23 74.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.329 0.652 . . . . 0.0 112.341 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -75.9 -12.31 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.601 -0.687 . . . . 0.0 111.824 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.98 14.02 32.39 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-O 118.808 -0.995 . . . . 0.0 113.039 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -79.01 108.99 12.9 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.263 1.531 . . . . 0.0 109.095 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 114.58 5.31 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.406 -0.809 . . . . 0.0 109.102 164.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 -64.61 163.64 13.34 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 124.677 1.191 . . . . 0.0 110.808 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.99 134.14 52.3 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 155.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.6 m -132.01 159.7 70.97 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 166.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.64 114.24 3.43 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.744 1.63 . . . . 0.0 110.983 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -71.22 173.27 7.92 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.185 -0.947 . . . . 0.0 110.288 170.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.76 -35.58 66.37 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.471 -0.768 . . . . 0.0 111.758 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -73.15 -20.9 60.81 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.037 0.535 . . . . 0.0 112.347 -178.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -73.35 -14.56 61.31 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.619 -0.676 . . . . 0.0 112.006 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.74 -19.46 54.53 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 124.398 0.999 . . . . 0.0 114.397 167.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -131.53 71.09 81.48 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 123.967 0.907 . . . . 0.0 109.738 171.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -63.21 156.95 52.37 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 122.223 1.948 . . . . 0.0 110.057 172.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.7 mt -89.8 134.9 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -130.51 165.5 22.55 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -135.14 155.04 51.38 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 175.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.2 m -151.73 115.15 4.8 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.387 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.7 113.56 25.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 170.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -161.75 -174.42 4.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.6 p -134.29 27.82 3.77 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.533 1.133 . . . . 0.0 112.116 -171.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 63.8 m -44.93 -36.48 3.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.052 1.741 . . . . 0.0 114.286 172.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.9 t -72.96 -28.75 62.59 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.669 1.122 . . . . 0.0 111.143 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.01 -23.54 5.54 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 127.536 2.494 . . . . 0.0 111.962 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 -117.57 172.21 7.49 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.852 1.661 . . . . 0.0 109.57 177.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -61.57 93.46 0.04 OUTLIER 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.262 1.025 . . . . 0.0 110.552 167.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -131.06 120.63 23.7 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 126.546 1.938 . . . . 0.0 107.14 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.94 30.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.985 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.2 p -152.79 174.25 14.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 159.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 163.89 -165.3 36.92 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 174.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -121.12 127.66 51.81 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -93.78 -7.15 44.31 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.246 1.418 . . . . 0.0 112.784 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 143.67 -44.8 0.92 Allowed Glycine 0 C--N 1.336 0.556 0 CA-C-N 118.382 0.537 . . . . 0.0 112.005 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 5.4 p -157.98 -32.03 0.07 Allowed 'General case' 0 CA--C 1.52 -0.201 0 O-C-N 120.86 -1.376 . . . . 0.0 111.717 173.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.63 -0.02 46.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -173.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . 0.278 0.8 OUTLIER 48.01 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 127.471 2.308 . . . . 0.0 113.385 -175.211 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -154.53 164.97 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.498 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.28 173.73 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.493 2.717 . . . . 0.0 107.707 167.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 148.53 174.69 20.44 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 125.628 1.585 . . . . 0.0 110.146 170.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.5 p -71.93 169.18 16.4 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.714 0.769 . . . . 0.0 110.755 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -148.99 174.78 11.91 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.471 0.708 . . . . 0.0 109.334 167.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.94 148.62 23.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.871 1.268 . . . . 0.0 108.983 169.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 114.4 26.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -151.11 166.26 31.35 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 53.55 13.4 0.47 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.233 1.813 . . . . 0.0 115.463 174.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.43 17.34 78.92 Favored Glycine 0 CA--C 1.531 1.059 0 O-C-N 120.495 -1.378 . . . . 0.0 112.56 -170.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.499 ' C ' HG21 ' A' ' 20' ' ' THR . 10.9 pttt -131.33 179.24 6.14 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 127.195 2.198 . . . . 0.0 110.129 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.05 109.39 20.82 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 104.433 -2.432 . . . . 0.0 104.433 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 57.6 p -97.45 152.82 18.58 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.019 0.827 . . . . 0.0 109.629 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.0 -164.81 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 110.266 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.9 -156.68 8.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 125.931 1.729 . . . . 0.0 111.595 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 t -74.71 71.03 1.91 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 172.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.1 mt -66.36 155.06 38.42 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.54 1.136 . . . . 0.0 108.096 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.85 -175.88 43.62 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 169.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.15 -149.72 5.18 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-O 121.794 0.663 . . . . 0.0 111.558 -167.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.3 p -100.18 -172.14 2.16 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 124.227 1.011 . . . . 0.0 109.993 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 mmt180 -135.5 87.84 2.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 171.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.3 mtt -114.42 165.2 12.97 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.633 1.173 . . . . 0.0 110.075 173.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.57 150.43 47.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 122.774 1.273 . . . . 0.0 110.602 163.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -145.09 147.16 32.24 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 130.411 3.484 . . . . 0.0 106.637 163.8 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ptp -129.09 28.6 5.27 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.953 1.701 . . . . 0.0 109.835 -177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.7 p -132.02 154.22 81.63 Favored Pre-proline 0 N--CA 1.446 -0.666 0 C-N-CA 125.953 1.701 . . . . 0.0 107.663 -168.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.15 -41.93 11.89 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.303 1.335 . . . . 0.0 109.348 176.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -62.51 -17.14 56.51 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-O 118.003 -1.443 . . . . 0.0 113.268 176.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.86 -56.11 12.01 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 120.102 1.951 . . . . 0.0 110.869 167.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -73.94 -18.39 60.9 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.471 1.136 . . . . 0.0 113.047 -162.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 18.2 tt -66.77 -13.72 16.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 123.278 0.631 . . . . 0.0 111.403 172.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -50.06 -43.24 51.06 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 125.426 1.49 . . . . 0.0 111.439 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.71 -42.6 98.01 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-O 119.417 -0.657 . . . . 0.0 111.611 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.61 69.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.632 0.716 . . . . 0.0 109.638 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.72 -54.48 38.61 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.993 0.917 . . . . 0.0 110.477 -175.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.48 -50.05 66.18 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 174.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -48.31 74.23 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.89 0.314 . . . . 0.0 111.225 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.01 64.43 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.232 1.013 . . . . 0.0 112.88 -173.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.08 -14.72 61.45 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.782 1.174 . . . . 0.0 112.293 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 26.4 p -84.46 4.39 31.89 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 119.287 0.949 . . . . 0.0 111.368 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -133.38 80.88 1.9 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.43 2.292 . . . . 0.0 108.659 -171.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -118.03 51.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 119.331 0.969 . . . . 0.0 109.959 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.95 -32.58 73.02 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.973 -1.079 . . . . 0.0 111.622 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -128.32 168.09 16.02 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.182 1.393 . . . . 0.0 109.789 -175.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 t -162.97 -179.01 6.44 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.598 -164.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 172.3 69.79 0.04 OUTLIER Glycine 0 CA--C 1.534 1.221 0 CA-C-N 118.993 0.815 . . . . 0.0 114.279 -176.459 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.588 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.0 p -85.15 142.05 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-N 120.797 2.298 . . . . 0.0 109.078 171.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -105.76 96.2 6.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 166.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.565 ' HB2' ' HB1' ' A' ' 19' ' ' ALA . 32.2 tpp -81.96 60.62 4.88 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 171.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 110.14 2.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -48.23 132.34 12.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.893 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.57 119.82 5.5 Favored 'Cis proline' 0 C--N 1.347 0.493 0 CA-C-N 119.543 0.872 . . . . 0.0 111.3 -0.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.07 136.69 37.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -140.91 165.87 26.34 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.82 2.448 . . . . 0.0 105.605 171.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 27.7 ttp -131.29 128.88 40.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 174.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -112.62 146.39 38.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 169.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 37.5 mt -135.11 139.99 45.12 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 73.9 t -129.07 126.24 64.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 -168.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.9 mp -73.95 165.92 24.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 122.666 1.222 . . . . 0.0 108.733 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -58.01 -36.12 72.22 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.724 1.21 . . . . 0.0 109.892 167.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -72.04 -19.86 61.77 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.895 1.678 . . . . 0.0 110.498 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.44 12.54 57.06 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-O 118.307 -1.274 . . . . 0.0 114.388 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.33 145.59 47.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.09 1.945 . . . . 0.0 107.423 164.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 15.1 m -125.12 96.6 4.91 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 124.947 1.299 . . . . 0.0 109.163 -177.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.54 127.58 33.0 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.072 -1.018 . . . . 0.0 108.333 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 36.7 m -113.95 118.52 34.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.391 1.877 . . . . 0.0 107.644 -175.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -114.74 150.58 35.12 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.148 1.379 . . . . 0.0 108.785 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.13 149.3 21.57 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.279 1.031 . . . . 0.0 108.986 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.0 tpt85 -71.48 107.11 4.23 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 163.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.68 89.03 2.97 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 170.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 t -115.57 50.34 1.01 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 122.038 0.923 . . . . 0.0 108.91 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.019 -1.467 . . . . 0.0 107.778 -179.213 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 111.585 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.07 144.71 58.2 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.215 1.406 . . . . 0.0 111.175 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.18 -26.15 5.36 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.634 2.89 . . . . 0.0 111.474 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.69 30.32 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.114 1.365 . . . . 0.0 112.538 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.405 ' HB1' ' SD ' ' A' ' 122' ' ' MET . . . -120.71 -11.06 9.08 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.303 2.641 . . . . 0.0 110.558 173.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -59.63 -39.17 83.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.122 0.969 . . . . 0.0 112.389 -169.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -28.16 69.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.675 -1.265 . . . . 0.0 113.072 177.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.3 mp -81.86 34.68 0.4 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.947 1.699 . . . . 0.0 110.108 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.35 -6.45 17.16 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.461 1.105 . . . . 0.0 110.898 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -60.77 -27.81 68.26 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.294 1.837 . . . . 0.0 114.901 -166.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -102.14 -14.09 17.2 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.621 1.568 . . . . 0.0 113.083 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.2 p -89.43 174.88 7.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.756 -149.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 3.9 p -124.12 -73.96 0.63 Allowed 'General case' 0 CA--C 1.503 -0.84 0 O-C-N 121.13 -0.981 . . . . 0.0 112.388 -171.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 6.6 m95 69.82 162.68 0.23 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.584 1.954 . . . . 0.0 111.421 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.6 t -144.3 135.3 21.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 177.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.23 131.85 40.67 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.9 t -116.96 -26.17 6.97 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.626 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -153.87 146.38 24.07 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 121.325 1.875 . . . . 0.0 112.458 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.698 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -137.98 101.63 4.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 127.808 2.443 . . . . 0.0 107.36 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -84.8 131.87 34.49 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 169.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.82 167.12 17.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 163.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.28 -29.72 66.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.114 0.884 . . . . 0.0 112.459 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.29 -16.83 28.52 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.757 0.708 . . . . 0.0 112.582 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.2 -1.81 11.56 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.703 1.144 . . . . 0.0 113.4 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 m -64.33 93.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.667 1.734 . . . . 0.0 109.096 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.4 107.22 0.63 Allowed 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.677 -1.264 . . . . 0.0 109.719 169.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.45 142.75 57.73 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.776 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.63 130.94 41.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.7 m -128.77 153.88 79.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 174.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -70.1 113.32 3.39 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.129 1.219 . . . . 0.0 110.26 -177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -62.14 169.15 2.88 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.338 0.655 . . . . 0.0 110.664 166.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.35 62.53 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.978 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -102.01 -9.26 20.77 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -68.81 -15.26 63.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.268 -0.872 . . . . 0.0 112.024 173.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.67 -79.57 0.28 Allowed Glycine 0 C--N 1.336 0.551 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.26 86.18 58.58 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 128.211 2.604 . . . . 0.0 108.13 -168.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.85 160.21 47.89 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.443 2.096 . . . . 0.0 111.594 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 108' ' ' TYR . 26.6 mt -75.17 103.56 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 176.257 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 p -103.29 157.81 16.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.599 0.759 . . . . 0.0 109.644 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -127.21 157.92 38.51 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.516 1.127 . . . . 0.0 109.223 169.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -141.7 128.15 20.06 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.547 1.539 . . . . 0.0 108.328 163.205 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.98 121.13 38.53 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 126.457 1.903 . . . . 0.0 106.159 161.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -151.57 -167.72 2.88 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 173.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 p -131.26 21.82 4.81 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.755 1.622 . . . . 0.0 111.277 -171.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.3 t -63.28 -29.76 71.03 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.226 1.41 . . . . 0.0 113.819 -165.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -78.99 -10.73 59.92 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.098 -1.001 . . . . 0.0 111.346 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.16 -6.35 58.07 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 125.803 1.668 . . . . 0.0 111.667 -169.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -132.3 166.93 20.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.533 1.533 . . . . 0.0 110.215 -176.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.2 ptp85 -66.04 74.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.815 2.046 . . . . 0.0 111.944 173.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.25 140.9 36.78 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.39 148.11 38.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.3 p -152.3 166.75 30.83 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.58 -169.4 40.4 Favored Glycine 0 C--N 1.331 0.29 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.26 132.96 51.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 169.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.2 m -114.52 22.88 13.24 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.475 1.91 . . . . 0.0 110.836 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.56 -73.5 0.46 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-O 117.287 -1.84 . . . . 0.0 112.08 178.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -144.51 -4.92 0.76 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 121.579 2.69 . . . . 0.0 113.878 179.591 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.433 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 16.3 m120 -115.97 -6.27 11.99 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.226 1.411 . . . . 0.0 114.268 -172.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 61.98 174.86 0.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 131.493 3.917 . . . . 0.0 111.74 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -147.68 161.2 41.65 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.369 0.604 . . . . 0.0 111.719 170.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.8 164.83 37.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.576 2.351 . . . . 0.0 108.266 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.07 173.98 27.18 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 174.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.0 p -89.33 160.64 16.77 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 122.123 -0.633 . . . . 0.0 109.755 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -140.26 -174.62 3.99 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.756 -0.59 . . . . 0.0 111.75 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -153.19 165.76 34.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.627 1.571 . . . . 0.0 108.542 166.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 79.5 mt -128.88 105.43 8.22 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -163.08 170.34 18.08 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 126.181 1.792 . . . . 0.0 108.65 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.62 21.7 7.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.061 1.344 . . . . 0.0 112.966 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.36 19.88 64.8 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 118.467 -1.185 . . . . 0.0 112.653 -171.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -139.78 178.74 7.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.397 1.599 . . . . 0.0 111.19 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 tt -115.41 113.37 23.66 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.14 134.09 36.95 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 170.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -88.69 -172.78 3.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.08 -149.01 7.91 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 126.664 2.078 . . . . 0.0 109.641 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.0 t -61.56 110.34 1.45 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 mt -88.21 169.62 11.72 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.333 1.453 . . . . 0.0 109.4 171.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.55 177.59 46.51 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 158.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.1 -173.68 25.84 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 70.1 p -71.4 179.45 2.94 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.889 0.876 . . . . 0.0 111.425 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.49 47.65 2.51 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.183 1.393 . . . . 0.0 108.297 172.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.7 mtm -63.1 157.08 23.15 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -112.1 129.82 56.1 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 96.9 m -136.71 125.74 24.4 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.883 2.073 . . . . 0.0 108.319 -169.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.5 mtp -90.73 53.06 2.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.994 0.902 . . . . 0.0 109.795 -174.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.7 p -134.55 153.29 78.99 Favored Pre-proline 0 C--O 1.239 0.507 0 C-N-CA 124.394 1.077 . . . . 0.0 108.25 -170.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -72.63 -37.77 3.78 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.257 1.305 . . . . 0.0 108.883 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.07 15.64 6.36 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 118.056 -1.413 . . . . 0.0 111.933 172.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -113.19 -11.0 14.3 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-N 120.504 2.152 . . . . 0.0 111.855 163.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -88.39 -21.06 24.5 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 169.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.4 tt -71.16 -14.1 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 120.093 1.315 . . . . 0.0 113.179 -169.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -57.34 -41.44 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 121.004 -1.06 . . . . 0.0 112.516 -172.346 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.12 -47.44 87.57 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 124.346 0.974 . . . . 0.0 111.249 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.39 -51.42 67.62 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.755 0.778 . . . . 0.0 109.678 177.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.413 ' CE1' HG21 ' A' ' 52' ' ' ILE . 52.1 t80 -64.5 -40.57 95.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.487 0.315 . . . . 0.0 111.359 -170.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.3 mp -61.5 -37.19 82.78 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 121.256 -0.903 . . . . 0.0 110.467 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -21.16 65.07 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.36 -39.74 20.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.0 -13.5 35.99 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.134 0.974 . . . . 0.0 113.141 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 46.9 p -97.84 8.89 43.96 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.01 1.324 . . . . 0.0 110.838 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -134.96 65.21 1.57 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 109.637 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -100.85 79.37 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 169.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.83 -36.52 78.3 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 118.699 -1.2 . . . . 0.0 110.211 170.145 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.588 ' HG2' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -130.69 161.27 32.02 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.444 1.098 . . . . 0.0 110.966 -174.701 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.6 m -149.25 169.74 20.06 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 158.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -159.71 162.16 32.79 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 108.09 -2.004 . . . . 0.0 108.09 153.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 45.0 t -124.74 145.04 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -110.08 93.3 4.43 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 170.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.405 ' SD ' ' HB1' ' A' ' 19' ' ' ALA . 18.2 mtp -80.2 35.2 0.32 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.442 1.097 . . . . 0.0 111.495 176.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -132.12 124.71 29.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 -178.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.62 148.83 65.17 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.973 0.909 . . . . 0.0 110.573 -173.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.9 122.39 5.6 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 N-CA-C 108.895 -1.233 . . . . 0.0 108.895 -14.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -71.52 135.24 46.99 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.11 0.481 . . . . 0.0 110.705 -168.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -139.26 168.81 18.99 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.799 1.24 . . . . 0.0 109.282 174.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -132.2 143.63 50.08 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.666 1.986 . . . . 0.0 106.843 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -138.01 139.39 39.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.883 0.849 . . . . 0.0 110.333 -174.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.79 ' H ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -134.09 161.12 35.75 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 127.675 2.39 . . . . 0.0 109.516 176.881 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.588 ' HB ' ' HG2' ' A' ' 117' ' ' ARG . 25.2 t -133.54 136.55 54.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 103.642 -2.725 . . . . 0.0 103.642 172.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 1.4 mp -82.71 162.1 21.89 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 172.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -66.11 -26.57 67.52 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.483 0.659 . . . . 0.0 111.731 -173.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.36 -5.92 58.36 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.615 1.566 . . . . 0.0 111.619 176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 103.22 4.41 47.38 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.997 -1.446 . . . . 0.0 115.441 169.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -62.07 158.46 16.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.589 1.695 . . . . 0.0 109.25 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.0 m -128.54 115.25 17.83 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.806 1.242 . . . . 0.0 109.981 -176.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.698 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.2 mm? -116.03 152.23 33.96 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.722 -0.611 . . . . 0.0 109.61 -177.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 98.1 m -145.49 119.79 9.58 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.567 -164.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.571 ' CE1' HD11 ' A' ' 130' ' ' LEU . 78.0 m-85 -113.82 140.25 48.47 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 123.518 0.727 . . . . 0.0 110.28 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.4 136.11 33.98 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.415 1.486 . . . . 0.0 107.708 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -60.91 136.93 58.23 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 117.803 -1.094 . . . . 0.0 108.21 174.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.0 t -138.42 35.91 2.27 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 119.661 1.118 . . . . 0.0 111.189 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.9 m -76.75 25.21 0.14 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.943 1.297 . . . . 0.0 109.822 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.7 ttt180 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 127.85 2.46 . . . . 0.0 111.736 171.552 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 121.695 0.759 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -112.0 144.14 30.13 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.749 -170.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.46 -26.42 14.22 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.049 3.166 . . . . 0.0 111.902 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.77 49.82 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.584 171.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -156.16 -43.57 0.08 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.919 2.487 . . . . 0.0 108.26 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 m -60.8 -16.9 45.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.994 2.517 . . . . 0.0 114.206 -164.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -74.44 -24.05 59.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.943 1.697 . . . . 0.0 113.466 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -72.42 -4.42 30.08 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.467 1.507 . . . . 0.0 111.155 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 38.98 0.57 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.875 1.27 . . . . 0.0 111.278 -160.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.77 -51.54 7.14 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.692 0.797 . . . . 0.0 110.756 175.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.07 -3.09 28.16 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.211 1.004 . . . . 0.0 112.232 -158.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.61 167.24 11.6 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 123.059 1.409 . . . . 0.0 111.584 -156.185 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.9 p -141.72 155.69 45.64 Favored 'General case' 0 CA--C 1.496 -1.122 0 O-C-N 120.07 -1.644 . . . . 0.0 106.822 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.723 ' CD1' HD13 ' A' ' 54' ' ' LEU . 9.1 m95 -145.62 169.07 19.16 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.433 -175.142 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.0 t -136.02 124.03 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 169.596 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 52' ' ' ILE . 2.0 tm? -79.98 129.82 34.79 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 -7.78 3.57 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.91 141.7 19.05 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-N 119.666 1.121 . . . . 0.0 111.389 173.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.605 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -127.47 118.81 24.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 128.562 2.745 . . . . 0.0 106.19 174.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -98.71 130.75 45.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -66.28 168.26 9.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 118.359 0.527 . . . . 0.0 109.793 163.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.13 71.61 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.479 1.111 . . . . 0.0 112.14 -174.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -23.57 63.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.811 0.339 . . . . 0.0 110.733 -177.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 110.33 3.14 29.4 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.663 2.078 . . . . 0.0 112.248 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.6 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.049 1.424 . . . . 0.0 108.807 177.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.14 115.92 4.15 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 168.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.44 168.87 15.21 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.082 0.553 . . . . 0.0 109.623 172.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.75 152.3 27.06 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 151.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.42 ' HB ' ' HD2' ' A' ' 44' ' ' PRO . 23.4 m -140.36 165.65 28.79 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 125.983 1.713 . . . . 0.0 108.492 170.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 43' ' ' VAL . 19.5 Cg_endo -66.46 105.77 0.94 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.005 2.47 . . . . 0.0 110.454 169.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.444 ' H ' ' HG3' ' A' ' 48' ' ' GLN . 0.7 OUTLIER -73.18 174.87 7.37 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.563 1.145 . . . . 0.0 111.352 167.798 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.76 -49.33 76.93 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.932 0.493 . . . . 0.0 112.241 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.24 3.96 52.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.444 ' HG3' ' H ' ' A' ' 45' ' ' SER . 27.3 mm-40 -70.22 -24.99 63.19 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.328 -0.857 . . . . 0.0 110.641 171.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.66 -44.38 0.72 Allowed Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.306 0.955 . . . . 0.0 112.533 173.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.29 85.44 5.41 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 127.198 2.199 . . . . 0.0 109.953 -165.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -69.53 138.6 38.94 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 123.176 2.584 . . . . 0.0 112.807 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 30' ' ' LEU . 3.4 mt -62.95 119.43 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.927 0.891 . . . . 0.0 109.61 163.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -124.37 119.28 28.79 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 172.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.723 HD13 ' CD1' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -72.35 144.23 48.34 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.911 1.284 . . . . 0.0 108.608 173.651 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.9 m -148.77 103.02 3.34 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 166.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.502 HD22 HD22 ' A' ' 54' ' ' LEU . 1.6 mm? -82.26 126.81 32.54 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 162.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.7 t -170.25 -159.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.89 51.2 1.13 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.932 0.893 . . . . 0.0 112.231 171.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.1 t -57.88 -39.5 77.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.395 1.078 . . . . 0.0 112.526 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.51 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 3.6 t -81.33 -10.93 59.46 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.571 0.748 . . . . 0.0 112.361 174.001 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.09 -12.25 40.77 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.177 1.37 . . . . 0.0 112.87 -173.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -120.87 162.32 20.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.591 1.695 . . . . 0.0 110.168 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.4 ptp85 -63.06 94.97 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.553 0.741 . . . . 0.0 110.861 176.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.51 ' CE1' ' HB ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -138.7 154.41 48.58 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.144 0.973 . . . . 0.0 109.284 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.96 92.86 9.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -169.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.2 p -98.09 66.49 1.83 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 122.257 1.027 . . . . 0.0 109.84 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.06 161.29 26.63 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 29.4 t80 -88.0 119.41 28.34 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 157.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -83.92 176.57 8.79 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 160.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.77 11.16 6.1 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.958 1.266 . . . . 0.0 115.374 -155.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -159.38 3.29 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 141.659 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 m-20 -135.84 125.69 25.73 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 106.135 -1.802 . . . . 0.0 106.135 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.549 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -69.5 139.61 53.88 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.772 -0.58 . . . . 0.0 110.03 168.599 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -112.74 169.04 9.18 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 126.236 1.814 . . . . 0.0 108.86 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.7 ptp -157.5 146.47 19.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.054 1.742 . . . . 0.0 107.516 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.56 156.33 7.97 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.571 -0.612 . . . . 0.0 111.571 168.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -94.83 120.5 35.15 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 122.613 0.365 . . . . 0.0 111.969 -146.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.501 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 41.3 p90 -98.0 171.09 8.49 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.195 0.522 . . . . 0.0 112.175 -169.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.51 145.67 25.35 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 126.738 2.015 . . . . 0.0 107.993 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.73 117.43 29.32 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 170.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -159.23 3.12 0.09 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -173.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -137.82 9.65 2.84 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.088 0.955 . . . . 0.0 113.454 -161.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.97 11.4 50.93 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.252 -1.53 . . . . 0.0 112.01 -157.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -137.87 165.94 25.25 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 126.93 2.092 . . . . 0.0 109.49 169.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -75.08 146.52 41.4 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 128.362 2.665 . . . . 0.0 107.375 163.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m -127.47 138.14 52.87 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 153.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -85.48 164.12 18.03 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.14 -171.65 44.45 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.108 -1.997 . . . . 0.0 108.108 165.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 m -58.37 106.53 0.39 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 165.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.4 mt -82.81 156.37 23.69 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -154.2 167.01 32.27 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 165.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.09 179.46 21.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.613 0.707 . . . . 0.0 111.901 -174.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.0 p -67.18 172.13 5.01 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -120.52 77.34 1.26 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 169.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 30.5 mtt -76.86 158.78 30.55 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -98.11 111.89 24.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.219 1.408 . . . . 0.0 108.243 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 77.9 m -145.58 129.08 16.99 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.847 0.832 . . . . 0.0 110.998 -167.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.3 mtm -107.54 57.17 0.63 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.115 1.766 . . . . 0.0 107.521 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.8 p -142.58 150.79 55.49 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 123.34 0.656 . . . . 0.0 110.396 -164.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.99 -21.76 31.98 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.26 1.974 . . . . 0.0 111.236 176.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.86 -14.88 68.88 Favored Glycine 0 CA--C 1.524 0.645 0 C-N-CA 124.723 1.154 . . . . 0.0 112.935 173.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 -38.98 68.67 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 118.582 1.191 . . . . 0.0 111.411 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -92.5 -26.24 18.04 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.621 0.71 . . . . 0.0 112.445 -173.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.72 -14.15 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 119.388 0.995 . . . . 0.0 111.451 174.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -50.34 -43.87 54.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.121 0.969 . . . . 0.0 110.551 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.84 97.56 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.565 -0.614 . . . . 0.0 111.565 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.89 -37.11 75.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 117.622 0.711 . . . . 0.0 110.522 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -62.47 -48.77 78.14 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.567 0.747 . . . . 0.0 109.992 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.0 -33.04 74.57 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.89 0.768 . . . . 0.0 110.737 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.22 -32.96 74.71 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.964 0.802 . . . . 0.0 111.992 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.73 72.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 123.367 0.667 . . . . 0.0 109.545 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -13.8 50.24 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 117.435 -1.269 . . . . 0.0 113.574 175.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 p -79.9 -9.46 59.68 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 121.012 1.733 . . . . 0.0 111.686 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -121.14 26.78 8.78 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.458 1.103 . . . . 0.0 112.386 -163.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.2 mm -68.54 90.92 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -90.13 -25.56 20.64 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 121.569 -0.707 . . . . 0.0 111.108 169.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -133.87 166.65 22.19 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 126.167 1.787 . . . . 0.0 110.307 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 m -160.21 146.59 15.67 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.54 1.536 . . . . 0.0 107.932 174.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -125.37 138.06 10.71 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 160.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.41 144.24 23.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 164.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -124.79 76.99 1.56 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 -173.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.5 mtp -81.16 27.31 0.41 Allowed 'General case' 0 C--O 1.23 0.069 0 C-N-CA 126.314 1.846 . . . . 0.0 113.821 -174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -121.51 109.06 14.37 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -51.52 126.22 29.53 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 124.271 1.029 . . . . 0.0 110.629 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.39 120.59 6.58 Favored 'Cis proline' 0 CA--C 1.534 0.52 0 O-C-N 122.63 0.805 . . . . 0.0 112.725 6.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -82.95 137.57 34.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.835 -0.541 . . . . 0.0 110.409 -170.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -142.51 175.85 9.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 107.573 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' MET . . . . . 0.414 ' HB2' ' CE3' ' A' ' 28' ' ' TRP . 7.1 tmm? -128.25 157.44 40.88 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 126.725 2.01 . . . . 0.0 105.937 172.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -155.15 112.03 3.27 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 169.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.834 HD11 ' HB2' ' A' ' 138' ' ' LEU 0.333 0.4 OUTLIER -80.97 163.94 22.93 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 172.627 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.9 t -135.93 130.99 49.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 104.74 -2.319 . . . . 0.0 104.74 166.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 14.5 mt -83.11 164.8 20.03 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -54.7 -37.08 65.38 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.21 1.004 . . . . 0.0 111.679 173.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -80.22 -14.57 58.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.342 1.057 . . . . 0.0 111.993 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.38 -7.61 34.68 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.603 1.097 . . . . 0.0 114.613 174.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -55.02 144.65 22.75 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.265 1.532 . . . . 0.0 108.666 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.3 m -135.54 110.94 9.09 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 125.294 1.438 . . . . 0.0 108.013 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.834 ' HB2' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -105.86 155.83 18.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 121.254 -0.903 . . . . 0.0 108.938 176.967 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 89.5 m -132.78 114.93 14.69 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.094 1.497 . . . . 0.0 108.946 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.409 ' CD1' ' HE3' ' A' ' 128' ' ' MET . 8.7 m-85 -124.81 139.54 53.75 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -175.123 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.3 OUTLIER -93.79 142.65 27.13 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 123.787 0.835 . . . . 0.0 109.078 178.706 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -65.68 119.5 11.28 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 116.382 -1.771 . . . . 0.0 109.694 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 5.7 t -124.08 38.34 4.21 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.671 2.032 . . . . 0.0 113.217 -172.145 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.3 p -74.89 17.2 0.23 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.753 1.221 . . . . 0.0 112.214 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.973 0 C-N-CA 125.118 1.367 . . . . 0.0 113.292 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 . . . . . 0 C--O 1.233 0.221 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.39 149.79 35.55 Favored Pre-proline 0 CA--C 1.532 0.269 0 O-C-N 121.591 -0.693 . . . . 0.0 111.052 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.37 -32.34 8.2 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 123.891 3.06 . . . . 0.0 111.103 170.007 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.3 40.78 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.007 2.123 . . . . 0.0 112.243 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.626 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -143.03 -17.26 0.67 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.845 1.658 . . . . 0.0 112.069 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -31.64 72.22 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.49 1.496 . . . . 0.0 111.272 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -57.73 -20.47 34.8 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -173.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.33 6.23 38.16 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.638 1.175 . . . . 0.0 111.158 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -89.97 78.09 6.8 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.404 1.482 . . . . 0.0 108.373 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -134.45 -27.78 1.33 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -128.24 0.93 5.77 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.954 1.702 . . . . 0.0 111.118 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.9 p -74.27 -172.76 1.5 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 125.692 1.597 . . . . 0.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.697 ' OG ' HG23 ' A' ' 55' ' ' THR . 0.4 OUTLIER -151.24 -63.9 0.19 Allowed 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.453 -1.404 . . . . 0.0 110.536 -176.41 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.2 m95 65.12 159.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 123.227 1.489 . . . . 0.0 112.438 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.5 t -140.97 129.61 24.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 103.744 -2.687 . . . . 0.0 103.744 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.431 HD13 ' CE2' ' A' ' 140' ' ' PHE . 39.6 tp -66.91 154.8 40.11 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 172.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.09 -20.8 0.25 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.46 -1.4 . . . . 0.0 111.67 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.26 140.05 29.0 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 118.753 0.706 . . . . 0.0 109.824 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -118.03 98.61 6.41 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.536 1.134 . . . . 0.0 108.442 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.55 134.33 34.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -74.96 166.96 22.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 123.011 0.524 . . . . 0.0 109.599 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.38 16.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 129.395 3.078 . . . . 0.0 115.226 172.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.6 -18.38 3.53 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.377 2.271 . . . . 0.0 111.202 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.14 3.99 35.74 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.255 0.931 . . . . 0.0 113.914 -175.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.7 m -88.08 113.27 23.55 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.615 1.566 . . . . 0.0 111.747 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.48 108.82 2.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.767 1.227 . . . . 0.0 113.343 165.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.11 161.51 8.53 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 126.096 1.758 . . . . 0.0 112.09 176.35 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 128.65 38.15 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 117.995 -1.002 . . . . 0.0 108.59 161.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.46 163.57 33.45 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 126.027 1.731 . . . . 0.0 108.318 174.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.2 107.59 2.23 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.652 2.235 . . . . 0.0 110.756 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.99 169.48 6.73 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.213 1.005 . . . . 0.0 111.536 170.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.96 -54.8 32.79 Favored 'General case' 0 C--O 1.231 0.124 0 O-C-N 121.632 -0.668 . . . . 0.0 110.451 175.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -10.53 52.56 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -176.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -75.99 -17.33 59.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.102 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.7 -88.34 0.2 Allowed Glycine 0 C--N 1.337 0.636 0 CA-C-N 119.306 0.957 . . . . 0.0 110.73 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.96 86.12 19.1 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.324 2.25 . . . . 0.0 109.129 -170.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -71.66 175.31 9.74 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.811 2.341 . . . . 0.0 112.079 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.85 110.38 22.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 127.915 2.486 . . . . 0.0 109.276 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 p -114.91 117.59 31.08 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.74 1.616 . . . . 0.0 109.072 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -81.99 165.33 20.78 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.697 HG23 ' OG ' ' A' ' 27' ' ' SER . 3.6 m -145.55 134.78 22.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 163.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -119.99 97.87 5.81 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 174.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.3 t -150.66 159.36 44.56 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -176.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -108.46 59.56 0.61 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.896 0.771 . . . . 0.0 109.924 -173.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -32.79 69.53 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.129 -0.357 . . . . 0.0 111.092 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.4 p -90.53 10.18 26.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 111.516 177.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.87 -14.24 0.41 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 125.649 1.595 . . . . 0.0 113.596 -164.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.407 HE22 ' CB ' ' A' ' 77' ' ' SER . 1.2 tm0? -96.39 157.69 15.78 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 177.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.6 ptp85 -68.29 72.67 0.2 Allowed 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 126.17 1.788 . . . . 0.0 111.75 175.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.95 132.64 34.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.928 1.291 . . . . 0.0 110.854 176.051 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.7 118.04 36.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.14 154.89 50.15 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 168.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.33 169.68 42.56 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -175.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -96.96 125.49 41.42 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.509 ' HB2' ' CE2' ' A' ' 108' ' ' TYR . 28.3 t -109.27 91.1 3.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.949 0.795 . . . . 0.0 109.218 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 84.18 -64.84 4.2 Favored Glycine 0 C--N 1.332 0.355 0 CA-C-O 118.613 -1.104 . . . . 0.0 110.994 151.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -134.41 -1.07 2.89 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.647 1.224 . . . . 0.0 111.854 163.508 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -144.73 118.86 9.45 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.532 1.133 . . . . 0.0 108.493 -163.404 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.44 160.86 27.5 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.762 -1.211 . . . . 0.0 113.325 173.479 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -133.35 170.38 15.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.567 2.747 . . . . 0.0 112.061 -176.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -153.59 166.78 31.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.612 1.565 . . . . 0.0 111.597 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.69 -163.84 30.52 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.661 1.601 . . . . 0.0 110.25 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.407 ' CB ' HE22 ' A' ' 62' ' ' GLN . 10.4 m -127.71 155.26 44.26 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.373 1.469 . . . . 0.0 109.824 -164.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TYR . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 52.3 p90 -138.97 179.47 6.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -174.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.82 148.2 30.65 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.297 1.839 . . . . 0.0 109.578 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 mp -117.31 103.78 10.49 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.248 2.219 . . . . 0.0 107.089 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.39 -175.08 5.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.549 168.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 53.42 16.19 0.84 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 165.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.81 14.26 58.03 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.051 -1.656 . . . . 0.0 114.285 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.4 pttt -132.72 160.73 35.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.716 1.758 . . . . 0.0 111.26 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.515 ' O ' HG21 ' A' ' 115' ' ' ILE . 17.1 tp -107.51 102.83 12.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 p -97.75 132.55 43.27 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.501 0.721 . . . . 0.0 109.077 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -96.19 -176.76 3.76 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.868 1.267 . . . . 0.0 109.944 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.67 -153.79 8.91 Favored Glycine 0 CA--C 1.521 0.45 0 C-N-CA 125.624 1.583 . . . . 0.0 111.062 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -64.27 85.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 123.228 1.489 . . . . 0.0 107.747 166.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 mt -78.34 178.31 7.77 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 119.923 -1.736 . . . . 0.0 108.52 169.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.97 -171.88 27.58 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 125.889 1.709 . . . . 0.0 109.41 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -179.43 -124.91 0.91 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 119.973 -1.108 . . . . 0.0 114.48 -171.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.1 p -102.59 169.67 8.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.346 1.058 . . . . 0.0 110.277 -165.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . 0.307 0.0 OUTLIER -128.05 40.91 3.59 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.294 1.038 . . . . 0.0 110.389 -174.914 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.0 mtt -58.8 140.9 54.44 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -91.14 124.89 35.7 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 91.3 m -136.99 169.09 18.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.121 1.368 . . . . 0.0 109.266 176.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.2 mtp -127.1 23.92 6.44 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.462 0.705 . . . . 0.0 110.26 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 43.8 p -101.89 158.75 31.17 Favored Pre-proline 0 C--O 1.238 0.481 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -168.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.22 -12.09 23.17 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.027 1.152 . . . . 0.0 112.159 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -92.61 -0.34 69.65 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 117.776 -1.569 . . . . 0.0 113.558 171.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.72 -45.67 4.19 Favored Glycine 0 CA--C 1.524 0.649 0 CA-C-N 120.239 2.019 . . . . 0.0 112.13 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -73.34 -22.5 60.29 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.812 1.306 . . . . 0.0 111.746 -174.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.7 tt -63.13 -14.33 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 O-C-N 121.503 -0.748 . . . . 0.0 112.352 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.514 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 5.3 tm-20 -66.56 -4.02 7.62 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.759 173.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.95 -64.17 1.9 Allowed Glycine 0 CA--C 1.533 1.214 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 164.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -33.29 74.47 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.287 -1.125 . . . . 0.0 112.626 -169.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.685 ' CE1' HD13 ' A' ' 109' ' ' LEU . 0.4 OUTLIER -63.6 -36.59 84.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.503 0.721 . . . . 0.0 110.428 -171.398 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.685 HD13 ' CE1' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -75.43 -23.21 56.93 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.694 1.198 . . . . 0.0 111.117 176.65 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.18 -24.17 40.51 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 171.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.95 -39.74 61.17 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 123.218 0.607 . . . . 0.0 109.493 173.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.3 -14.51 27.32 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 56.8 p -82.35 -4.31 57.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.671 1.578 . . . . 0.0 112.494 175.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -118.2 84.07 2.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.229 1.412 . . . . 0.0 109.252 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.515 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.5 mm -128.37 60.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.29 -29.48 66.24 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.556 1.169 . . . . 0.0 110.048 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.542 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -141.03 158.29 44.14 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.03 1.395 . . . . 0.0 112.781 -178.507 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 130' ' ' LEU . 21.0 m -151.41 171.98 16.66 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 125.336 1.454 . . . . 0.0 108.495 174.245 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.64 99.33 0.18 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 108.528 -1.829 . . . . 0.0 108.528 172.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.7 p -100.61 136.24 33.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 O-C-N 121.263 -1.139 . . . . 0.0 108.987 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -107.8 76.65 1.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.574 ' CG ' ' HB1' ' A' ' 19' ' ' ALA . 79.0 mmm -71.74 50.92 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.707 -1.245 . . . . 0.0 111.824 175.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.5 tpp85 -134.99 129.12 33.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.19 130.03 94.26 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 117.647 -1.168 . . . . 0.0 109.849 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.89 119.45 6.16 Favored 'Cis proline' 0 CA--C 1.54 0.81 0 CA-C-N 119.7 0.928 . . . . 0.0 112.824 3.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -84.76 131.78 34.52 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.92 1.288 . . . . 0.0 109.691 -168.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -141.85 167.96 20.89 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 125.803 1.641 . . . . 0.0 108.95 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 7.5 tmm? -122.75 134.99 54.43 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.1 144.44 46.6 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 162.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.87 ' H ' HD12 ' A' ' 130' ' ' LEU 0.305 0.1 OUTLIER -112.64 167.71 10.25 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.03 0.932 . . . . 0.0 109.072 160.491 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.542 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 59.4 t -124.0 147.87 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 157.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.11 161.03 15.27 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 172.18 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.21 -25.05 30.54 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.334 0.97 . . . . 0.0 111.526 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -82.43 -19.35 39.18 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 125.263 1.425 . . . . 0.0 112.009 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 113.94 -9.51 23.21 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.591 1.567 . . . . 0.0 114.484 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 148.19 23.97 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.64 1.72 . . . . 0.0 109.421 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.06 99.02 3.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.978 0.911 . . . . 0.0 108.682 -168.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 130' ' ' LEU . 6.4 mp -86.75 142.7 27.95 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 119.733 -1.855 . . . . 0.0 108.504 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 90.1 m -109.22 125.22 52.01 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.755 1.622 . . . . 0.0 107.822 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.431 ' CE2' HD13 ' A' ' 30' ' ' LEU . 57.4 m-85 -119.17 151.34 38.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 124.048 0.939 . . . . 0.0 110.453 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -99.32 147.83 24.79 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.937 1.695 . . . . 0.0 108.824 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -76.06 111.49 11.51 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 6.5 t -111.43 93.95 4.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 168.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 9.4 t -117.4 26.37 9.79 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.012 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.297 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.234 0.279 0 CA-C-O 122.389 1.09 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -70.99 143.68 89.22 Favored Pre-proline 0 N--CA 1.454 -0.256 0 CA-C-O 117.681 -1.152 . . . . 0.0 108.883 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -78.69 -16.75 12.89 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.959 2.439 . . . . 0.0 112.073 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.91 39.93 0.14 Allowed 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 122.751 1.262 . . . . 0.0 111.602 174.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 122' ' ' MET . . . -139.43 -46.22 0.46 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 130.065 3.346 . . . . 0.0 106.4 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.481 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -60.83 -20.69 62.16 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.593 1.157 . . . . 0.0 112.843 -176.123 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.3 -12.0 54.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 114.773 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 7.18 46.61 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.565 1.546 . . . . 0.0 110.589 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 20' ' ' THR . 2.7 mm? -82.15 56.32 3.14 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.381 -1.449 . . . . 0.0 109.312 -176.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -135.57 -40.22 0.71 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.623 -0.703 . . . . 0.0 112.296 -161.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.1 39.43 3.67 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 172.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 p -120.92 157.74 29.2 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.506 -1.371 . . . . 0.0 110.975 -174.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -127.6 152.47 47.6 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 123.99 0.916 . . . . 0.0 109.106 -178.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -149.59 162.5 40.07 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 113.257 -1.792 . . . . 0.0 108.604 -166.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.7 t -147.58 136.04 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 140' ' ' PHE . 17.2 tp -82.25 150.65 27.19 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 119.276 0.944 . . . . 0.0 110.311 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 t -134.31 -27.32 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 175.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -151.79 157.97 42.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.309 1.413 . . . . 0.0 110.389 177.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.745 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.2 t90 -143.35 106.6 4.55 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.082 2.153 . . . . 0.0 108.469 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.07 131.61 34.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 172.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -61.53 161.61 9.38 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 159.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -44.32 -42.95 7.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.158 1.783 . . . . 0.0 112.654 165.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.23 -14.23 62.17 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.683 1.593 . . . . 0.0 111.987 -173.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.55 1.72 58.93 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.948 1.737 . . . . 0.0 112.64 -175.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.1 m -69.4 108.89 3.92 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.073 1.749 . . . . 0.0 109.794 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.39 140.36 48.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.153 -0.967 . . . . 0.0 110.64 170.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -97.05 166.47 11.58 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.436 1.494 . . . . 0.0 111.606 -175.342 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.5 102.99 13.96 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 173.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 28.0 m -114.43 148.89 41.21 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 173.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.7 102.69 1.64 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.137 2.558 . . . . 0.0 110.203 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.08 169.31 0.4 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 126.162 1.785 . . . . 0.0 114.442 168.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.87 -37.38 71.26 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.046 0.938 . . . . 0.0 112.873 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -80.86 -15.2 57.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -73.85 -22.92 59.59 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 121.589 -0.694 . . . . 0.0 111.515 -172.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.56 -32.14 2.34 Favored Glycine 0 C--N 1.337 0.604 0 N-CA-C 115.335 0.894 . . . . 0.0 115.335 156.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.17 85.26 8.2 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 172.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 162.28 39.82 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.035 1.823 . . . . 0.0 111.22 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.7 mt -77.99 106.85 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 124.537 1.135 . . . . 0.0 109.093 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -99.41 159.02 15.32 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.377 0.671 . . . . 0.0 109.629 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -140.16 141.97 36.0 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.402 2.281 . . . . 0.0 106.465 165.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.2 m -134.37 145.84 49.35 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 120.833 -1.167 . . . . 0.0 108.146 159.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.4 mt -118.4 117.32 28.74 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 103.71 -2.7 . . . . 0.0 103.71 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -163.54 178.7 7.79 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 171.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.0 p -116.92 16.46 15.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -161.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -51.72 -32.68 31.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.1 p -65.97 -21.82 66.44 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 121.336 1.88 . . . . 0.0 111.875 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.92 -0.03 60.47 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.897 1.713 . . . . 0.0 111.01 -160.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -131.27 167.8 18.6 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.106 1.453 . . . . 0.0 109.771 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -71.51 80.38 0.79 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.732 2.013 . . . . 0.0 106.742 173.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -106.07 112.79 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.518 1.527 . . . . 0.0 109.083 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.54 149.88 45.32 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 168.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -145.65 152.42 39.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 167.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 176.71 -168.74 40.9 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 6.0 t80 -131.55 128.73 39.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 103.34 -2.837 . . . . 0.0 103.34 172.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.4 m -119.59 11.19 11.97 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.443 1.02 . . . . 0.0 113.594 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 169.25 -63.09 0.18 Allowed Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.295 -1.281 . . . . 0.0 112.122 168.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 9.2 t -166.96 9.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.632 1.716 . . . . 0.0 113.713 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -112.06 -7.66 14.08 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 118.813 -2.429 . . . . 0.0 112.92 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.402 ' HA ' ' HA ' ' A' ' 68' ' ' PHE 0.321 0.0 OUTLIER 44.21 179.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 127.615 2.366 . . . . 0.0 113.07 -164.246 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 10.2 p90 -160.25 166.77 28.94 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.645 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -157.37 168.3 27.77 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.957 2.503 . . . . 0.0 106.392 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 143.9 175.88 17.42 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.431 1.015 . . . . 0.0 110.876 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.4 m -79.54 164.43 23.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -166.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -142.55 176.84 8.72 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.642 1.177 . . . . 0.0 111.541 170.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -158.3 159.23 35.71 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.147 1.379 . . . . 0.0 110.283 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.87 128.62 50.6 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 125.385 1.474 . . . . 0.0 108.817 -177.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt 176.18 171.58 0.4 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 128.111 2.564 . . . . 0.0 107.175 -171.716 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t0 58.3 24.13 11.21 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 158.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.01 5.78 59.0 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 118.251 -1.305 . . . . 0.0 113.998 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.435 ' HA ' HG21 ' A' ' 20' ' ' THR . 14.5 pttt -131.31 168.41 17.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.806 1.803 . . . . 0.0 112.122 -171.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.5 tp -101.89 109.65 21.44 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 163.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -90.7 159.48 16.34 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -120.1 178.88 4.46 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.497 1.119 . . . . 0.0 110.126 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -101.87 -112.11 3.55 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 175.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 t -143.86 67.16 1.28 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 128.242 2.617 . . . . 0.0 105.284 -162.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.716 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -68.26 163.74 22.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.159 0.984 . . . . 0.0 111.031 -171.618 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.89 172.83 45.81 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 166.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.34 -134.46 2.8 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.2 p -103.22 -167.96 1.45 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.75 1.62 . . . . 0.0 109.774 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -128.24 67.47 1.36 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.045 1.738 . . . . 0.0 109.481 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.7 mtm -101.14 157.26 16.9 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.603 -0.685 . . . . 0.0 109.165 -176.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.27 118.72 32.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.038 0.935 . . . . 0.0 108.643 -171.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -102.37 -22.87 14.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 177.967 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.256 23.2 ptp 49.49 31.36 3.98 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -169.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 61.1 p -122.64 160.71 47.47 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.502 1.521 . . . . 0.0 107.47 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.8 -41.67 7.7 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.727 1.618 . . . . 0.0 111.632 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.93 -30.96 76.8 Favored Glycine 0 C--N 1.34 0.762 0 CA-C-O 118.699 -1.056 . . . . 0.0 111.005 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -68.98 -17.04 71.26 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.899 1.85 . . . . 0.0 113.242 173.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -98.91 -12.12 21.02 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.577 1.189 . . . . 0.0 112.385 -173.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.7 tt -81.95 -16.13 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -174.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -58.22 -37.65 75.26 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.911 0.778 . . . . 0.0 110.545 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.53 73.71 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-O 118.628 -1.095 . . . . 0.0 113.464 176.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.7 59.75 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 120.097 1.949 . . . . 0.0 110.158 173.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -71.52 -44.22 65.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.5 1.12 . . . . 0.0 110.668 -174.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.81 -28.17 68.59 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.566 -1.334 . . . . 0.0 111.272 172.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.56 -20.57 50.3 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 174.184 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.2 -37.61 25.8 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.457 1.503 . . . . 0.0 109.927 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -13.77 0.55 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.676 2.391 . . . . 0.0 114.584 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.3 p -114.96 -0.32 13.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.697 1.599 . . . . 0.0 113.09 -176.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -110.51 35.38 3.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.629 1.104 . . . . 0.0 109.973 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.3 mm -71.65 74.4 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.839 1.256 . . . . 0.0 108.017 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.87 -25.77 27.79 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.392 -0.817 . . . . 0.0 109.987 173.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -137.37 164.97 27.33 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 122.445 1.117 . . . . 0.0 112.609 174.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.4 m -158.6 162.91 37.36 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 127.577 2.351 . . . . 0.0 107.126 -176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.02 91.81 0.1 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 108.791 -1.724 . . . . 0.0 108.791 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 128' ' ' MET . 2.2 p -77.53 145.75 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 120.229 -1.748 . . . . 0.0 109.242 166.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -120.31 98.54 6.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.453 1.901 . . . . 0.0 107.401 174.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.424 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 12.2 mtp -88.42 1.79 54.01 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 177.436 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -61.81 132.08 51.96 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 157.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 140.73 98.16 Favored Pre-proline 0 N--CA 1.442 -0.852 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 170.949 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.42 118.68 4.71 Favored 'Cis proline' 0 N--CA 1.454 -0.8 0 CA-C-N 119.861 0.986 . . . . 0.0 110.558 -1.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -68.46 127.32 32.57 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.742 0.782 . . . . 0.0 109.213 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -140.41 161.49 37.57 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.286 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' MET . . . . . 0.402 ' HA ' ' HA ' ' A' ' 120' ' ' VAL . 40.2 ttp -115.39 148.87 38.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -130.21 133.61 46.68 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 176.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 52.7 mt -119.11 154.01 33.9 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.9 t -142.26 126.63 16.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.7 mt -84.45 170.91 13.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.452 . . . . 0.0 111.224 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -63.05 -2.17 1.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.56 1.944 . . . . 0.0 114.543 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -109.39 -10.29 14.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.89 1.676 . . . . 0.0 112.163 172.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.79 18.57 15.34 Favored Glycine 0 C--N 1.334 0.445 0 O-C-N 120.896 -1.128 . . . . 0.0 114.249 169.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.97 167.87 3.56 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.311 1.044 . . . . 0.0 110.982 174.973 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -139.66 104.15 4.85 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.348 -0.845 . . . . 0.0 109.059 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.745 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.6 OUTLIER -92.57 160.74 14.89 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.907 -1.12 . . . . 0.0 110.973 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 139' ' ' THR . . . . . 0.401 ' O ' HD12 ' A' ' 30' ' ' LEU . 2.6 m -134.85 110.7 9.34 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 122.572 0.349 . . . . 0.0 111.201 -174.113 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 77.7 m-85 -114.06 140.98 48.02 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 123.972 0.795 . . . . 0.0 110.387 173.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -85.97 147.27 26.3 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 163.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -64.51 137.07 57.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 160.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 36.5 t -123.91 104.58 9.01 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 120.197 1.362 . . . . 0.0 107.99 163.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.3 t -123.12 17.59 9.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 123.489 0.493 . . . . 0.0 111.316 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? . . . . . 0 C--O 1.251 1.172 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 154.499 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.704 -0.11 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -159.25 144.13 11.51 Favored Pre-proline 0 N--CA 1.468 0.47 0 O-C-N 121.301 -0.875 . . . . 0.0 111.583 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.79 -18.98 18.86 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.317 2.012 . . . . 0.0 111.942 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -13.32 23.62 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 119.23 0.923 . . . . 0.0 112.388 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.68 -25.64 49.68 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 119.726 1.148 . . . . 0.0 112.702 172.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -63.33 -31.02 72.07 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.822 0.849 . . . . 0.0 112.389 -160.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -21.8 66.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.753 0.706 . . . . 0.0 112.23 -175.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.0 mt -83.84 -9.43 58.77 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.449 1.1 . . . . 0.0 111.465 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.95 -13.52 62.49 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.813 0.845 . . . . 0.0 112.098 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -60.46 -9.82 4.15 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.801 2.04 . . . . 0.0 112.87 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -128.58 10.0 6.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.595 1.958 . . . . 0.0 111.483 -165.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.8 p -113.69 -174.76 2.53 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.463 -162.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -153.01 -66.58 0.16 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 118.211 -0.9 . . . . 0.0 112.186 -171.121 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.4 m95 65.88 171.29 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.91 1.284 . . . . 0.0 113.769 176.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.7 t -139.12 135.84 42.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 172.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.2 tp -74.44 143.24 44.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.83 -21.34 0.72 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 175.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -142.49 166.89 23.44 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 120.632 1.56 . . . . 0.0 111.388 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' ' CE1' ' A' ' 108' ' ' TYR . 5.9 t90 -150.65 101.48 2.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.06 2.144 . . . . 0.0 107.492 -176.02 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.6 145.11 25.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 170.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -88.44 172.31 9.46 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.386 0.674 . . . . 0.0 109.542 162.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.91 -34.48 73.25 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.273 1.029 . . . . 0.0 112.836 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.55 5.41 20.93 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.047 0.451 . . . . 0.0 110.823 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.61 11.66 60.41 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.221 1.391 . . . . 0.0 111.439 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 m -74.19 99.32 3.37 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 120.85 -1.383 . . . . 0.0 108.398 -174.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.5 104.36 1.24 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.158 0.98 . . . . 0.0 108.878 168.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 -59.4 157.5 11.01 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.78 1.232 . . . . 0.0 110.118 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.74 124.36 27.15 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.17 150.19 75.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.78 104.44 1.91 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.951 2.434 . . . . 0.0 110.179 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 169.26 11.24 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.006 1.322 . . . . 0.0 108.565 173.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.93 -46.43 71.53 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.786 -0.571 . . . . 0.0 111.618 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.34 -10.4 58.91 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.285 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -76.33 -12.04 60.0 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.851 0.86 . . . . 0.0 112.152 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.15 -32.97 4.54 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 124.337 0.97 . . . . 0.0 112.723 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.14 85.85 13.53 Favored Pre-proline 0 N--CA 1.449 -0.486 0 C-N-CA 125.993 1.717 . . . . 0.0 109.268 -171.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.3 132.8 32.69 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.76 1.64 . . . . 0.0 108.676 168.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.3 mt -69.99 98.95 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 O-C-N 121.913 -0.492 . . . . 0.0 109.821 173.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.9 p -75.9 154.0 36.32 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 171.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.67 155.04 39.85 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 172.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 17.6 m -141.9 137.4 31.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 85' ' ' LEU . 87.1 mt -128.99 60.4 1.55 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.272 1.429 . . . . 0.0 107.947 174.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.8 t -134.78 172.32 13.13 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.629 1.172 . . . . 0.0 108.238 -171.421 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -95.52 44.2 1.09 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.282 -1.511 . . . . 0.0 111.408 -160.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -13.38 6.04 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 p -121.18 0.03 10.04 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.158 2.183 . . . . 0.0 112.411 170.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.17 -39.79 2.66 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 127.991 2.71 . . . . 0.0 111.897 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -82.97 172.88 12.31 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.05 0.94 . . . . 0.0 108.691 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -75.87 76.47 2.79 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.956 0.884 . . . . 0.0 110.484 171.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -102.98 123.82 47.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.946 1.698 . . . . 0.0 106.992 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.96 144.49 31.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.872 1.669 . . . . 0.0 107.138 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.25 173.54 11.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 164.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.03 -168.72 38.57 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -135.02 95.19 3.26 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.0 m -73.66 77.37 1.52 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.054 1.341 . . . . 0.0 110.868 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.07 -63.57 1.65 Allowed Glycine 0 C--N 1.333 0.373 0 C-N-CA 125.003 1.287 . . . . 0.0 113.857 158.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.7 m -114.22 -16.95 11.97 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 119.509 1.655 . . . . 0.0 111.219 170.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.71 124.56 18.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 -157.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -73.9 162.66 28.85 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.822 1.296 . . . . 0.0 111.41 163.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -145.7 146.8 31.41 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 130.8 3.64 . . . . 0.0 107.049 -175.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 35.0 mtm -147.29 152.24 37.95 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.5 2.32 . . . . 0.0 106.404 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.23 175.22 34.86 Favored Glycine 0 C--N 1.32 -0.356 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.6 m -78.92 155.03 29.19 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.817 0.808 . . . . 0.0 111.168 -175.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 49.1 p90 -125.69 177.14 6.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.714 1.205 . . . . 0.0 110.558 167.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.4 153.49 34.81 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.099 1.76 . . . . 0.0 109.484 174.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.49 101.3 9.74 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 126.884 2.073 . . . . 0.0 105.666 178.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -154.8 158.88 40.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.487 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.0 t0 44.59 33.42 0.92 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.138 1.375 . . . . 0.0 114.692 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . 0.41 ' O ' HG21 ' A' ' 118' ' ' THR . . . 65.39 5.14 20.56 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 118.171 -1.349 . . . . 0.0 114.808 -175.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -123.51 145.64 48.7 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 120.099 1.95 . . . . 0.0 110.986 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -71.82 119.9 16.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 169.929 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -123.98 152.44 42.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 119.037 0.835 . . . . 0.0 109.536 177.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.541 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.9 m-85 -119.59 175.15 5.99 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -172.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.16 -112.48 3.71 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 125.322 1.439 . . . . 0.0 110.458 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -132.08 70.9 1.46 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 127.996 2.519 . . . . 0.0 105.44 -163.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.751 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -71.57 151.77 43.52 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.26 -172.286 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.14 162.99 21.3 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 107.315 -2.314 . . . . 0.0 107.315 172.377 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.17 -27.19 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.42 0 C-N-CA 119.602 -1.285 . . . . 0.0 113.698 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.5 p -163.85 170.01 17.42 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.346 2.658 . . . . 0.0 109.272 -167.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -128.85 29.35 5.24 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.793 1.637 . . . . 0.0 110.334 -175.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.6 mtt -60.38 141.28 56.52 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 111.137 -168.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -105.57 124.68 49.95 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.227 1.411 . . . . 0.0 108.49 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 59.2 m -127.01 167.85 15.35 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.001 0.92 . . . . 0.0 109.893 168.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 mtp -120.56 47.01 1.87 Allowed 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 -177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.9 p -132.83 156.98 79.48 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.97 1.708 . . . . 0.0 108.128 177.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -60.24 -47.95 13.24 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.967 2.444 . . . . 0.0 110.819 174.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.24 -11.37 58.93 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.922 -0.932 . . . . 0.0 112.115 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.85 -60.22 2.48 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 119.148 1.474 . . . . 0.0 111.521 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -75.95 -18.07 59.48 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.528 1.164 . . . . 0.0 113.939 -168.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.6 tt -60.97 -21.03 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.155 0.982 . . . . 0.0 112.467 176.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -45.77 -46.11 15.06 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.149 1.78 . . . . 0.0 110.52 174.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -66.08 -34.96 89.83 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.77 -1.206 . . . . 0.0 113.042 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.15 75.46 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.691 1.746 . . . . 0.0 110.358 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' TYR . . . . . 0.476 ' CE1' ' CZ3' ' A' ' 33' ' ' TRP . 10.1 m-85 -60.31 -62.09 2.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.079 1.352 . . . . 0.0 109.782 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.86 -23.29 63.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.426 -173.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -61.78 -59.21 5.5 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 123.012 0.525 . . . . 0.0 110.199 168.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.56 -29.82 70.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.907 1.283 . . . . 0.0 110.902 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tp -56.59 -21.21 25.23 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.935 1.294 . . . . 0.0 112.992 -175.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -85.96 -23.19 27.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.423 1.465 . . . . 0.0 112.223 177.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -94.42 37.95 1.11 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.475 1.51 . . . . 0.0 111.338 -166.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.7 mm -75.96 79.92 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 174.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -79.69 -30.31 41.06 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.433 -0.792 . . . . 0.0 109.982 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.401 ' HE ' HG12 ' A' ' 131' ' ' VAL . 20.5 mtm180 -132.98 173.62 11.21 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 127.549 2.34 . . . . 0.0 109.434 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.41 HG21 ' O ' ' A' ' 83' ' ' GLY . 4.8 t -159.23 -179.49 8.03 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -172.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.48 84.57 0.08 OUTLIER Glycine 0 CA--C 1.53 0.978 0 C-N-CA 123.691 0.663 . . . . 0.0 112.046 171.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.293 1.7 p -88.88 120.96 38.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 119.101 1.45 . . . . 0.0 109.863 171.515 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -90.09 96.52 10.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 175.085 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 43.6 tpp -87.71 60.29 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.582 1.182 . . . . 0.0 108.181 177.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -153.38 135.95 15.16 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 171.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.31 92.89 Favored Pre-proline 0 N--CA 1.443 -0.822 0 CA-C-N 118.568 0.622 . . . . 0.0 110.212 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.5 119.05 3.65 Favored 'Cis proline' 0 N--CA 1.459 -0.536 0 CA-C-N 119.336 0.799 . . . . 0.0 110.262 -8.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -72.5 127.31 32.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 122.208 1.004 . . . . 0.0 108.514 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -142.77 159.68 41.77 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 126.209 1.804 . . . . 0.0 106.527 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.7 ttp -142.17 104.61 4.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -165.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -69.78 144.49 52.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 161.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.75 152.12 33.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 149.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.401 HG12 ' HE ' ' A' ' 117' ' ' ARG . 64.6 t -135.38 120.2 27.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.46 165.75 21.9 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.055 1.407 . . . . 0.0 111.079 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -53.94 -36.94 63.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.98 2.112 . . . . 0.0 111.273 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -81.82 -11.4 58.98 Favored 'General case' 0 C--O 1.226 -0.166 0 O-C-N 120.915 -1.116 . . . . 0.0 110.431 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.05 12.11 30.43 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 123.981 0.801 . . . . 0.0 113.902 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.18 166.19 5.08 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.172 1.486 . . . . 0.0 110.57 174.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.1 m -151.09 99.5 2.69 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 120.405 -1.434 . . . . 0.0 109.956 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -78.05 166.45 22.8 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 121.119 -0.988 . . . . 0.0 109.769 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 18.3 m -132.47 120.91 22.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -119.53 156.6 29.98 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.844 0.715 . . . . 0.0 110.09 168.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 131.09 53.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 126.863 2.065 . . . . 0.0 108.514 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.24 110.55 2.62 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.341 1.457 . . . . 0.0 110.427 -176.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.91 73.69 1.51 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 170.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.3 m -88.54 37.45 0.83 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 168.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.156 0 O-C-N 119.97 -1.706 . . . . 0.0 111.042 -172.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.719 0.771 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -142.03 143.31 27.65 Favored Pre-proline 0 N--CA 1.457 -0.106 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.734 -173.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.24 -35.79 2.78 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.493 2.128 . . . . 0.0 111.212 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.48 72.96 1.01 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.523 1.929 . . . . 0.0 108.94 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.672 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -173.51 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 129.672 3.189 . . . . 0.0 108.037 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.5 m -63.31 -22.99 67.22 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.177 -0.952 . . . . 0.0 111.689 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -56.8 -15.99 5.75 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.499 1.12 . . . . 0.0 113.416 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.0 mt -98.42 5.14 48.35 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.683 1.193 . . . . 0.0 111.853 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.409 HD13 ' HE1' ' A' ' 28' ' ' TRP . 0.7 OUTLIER -75.11 75.01 2.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.939 1.696 . . . . 0.0 108.571 178.0 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -143.96 -29.29 0.5 Allowed 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 168.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -111.24 -5.52 14.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.892 1.277 . . . . 0.0 112.665 173.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.4 p -71.26 176.05 4.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.811 1.244 . . . . 0.0 110.814 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.3 OUTLIER -138.3 -64.67 0.52 Allowed 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 120.594 -1.316 . . . . 0.0 110.696 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.409 ' HE1' HD13 ' A' ' 23' ' ' LEU . 4.3 m95 67.77 163.01 0.2 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.974 1.71 . . . . 0.0 112.949 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -140.83 136.41 34.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 48.5 tp -85.26 135.58 33.86 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.92 -12.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 176.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.98 151.51 39.84 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.762 1.619 . . . . 0.0 111.714 172.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -142.17 101.16 3.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.31 1.844 . . . . 0.0 106.813 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.51 140.44 29.53 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.075 -1.016 . . . . 0.0 108.556 170.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.403 ' HA ' ' CG ' ' A' ' 136' ' ' ASP . 18.5 mt-30 -78.67 170.13 17.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.823 0.738 . . . . 0.0 111.542 166.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -21.8 38.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.313 2.245 . . . . 0.0 114.757 -177.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -111.08 1.86 17.59 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.528 1.058 . . . . 0.0 112.049 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 117.36 0.67 18.58 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.054 0.835 . . . . 0.0 113.795 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.2 m -67.62 95.29 0.47 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.156 1.478 . . . . 0.0 110.156 -175.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.35 107.08 1.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 O-C-N 120.16 -1.587 . . . . 0.0 111.091 171.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -65.72 159.9 24.06 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.974 1.709 . . . . 0.0 110.94 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.24 34.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 170.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.9 m -137.52 164.73 39.43 Favored Pre-proline 0 C--O 1.236 0.39 0 C-N-CA 123.824 0.85 . . . . 0.0 109.148 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 112.97 3.6 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 121.947 1.765 . . . . 0.0 110.478 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -64.74 178.09 0.84 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.151 0.981 . . . . 0.0 110.245 162.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.76 99.8 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.396 -0.815 . . . . 0.0 110.241 165.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -32.24 73.8 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.332 1.453 . . . . 0.0 110.91 -174.035 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -59.5 -12.99 7.28 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.219 1.808 . . . . 0.0 113.479 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -45.16 1.36 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 124.098 0.856 . . . . 0.0 111.563 165.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.88 77.89 75.98 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.447 1.499 . . . . 0.0 109.087 -175.107 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.22 154.72 69.44 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 124.569 3.513 . . . . 0.0 112.138 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.45 100.07 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.051 0.94 . . . . 0.0 108.472 171.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.3 p -92.14 154.78 18.48 Favored 'General case' 0 C--O 1.241 0.647 0 O-C-N 121.816 -0.552 . . . . 0.0 110.068 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -121.28 155.33 34.91 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.068 1.747 . . . . 0.0 106.882 173.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 8.9 m -147.78 99.48 3.1 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.568 -0.707 . . . . 0.0 109.667 176.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.89 125.35 29.14 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.06 -164.34 1.59 Allowed 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 p -139.16 24.15 2.54 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.737 2.815 . . . . 0.0 110.679 -169.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.9 p -68.62 0.44 4.15 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -167.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.0 p -117.5 1.5 12.32 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.962 1.705 . . . . 0.0 110.933 171.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.4 -48.35 0.95 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 127.447 2.451 . . . . 0.0 110.564 -176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -93.26 170.68 9.44 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.751 1.62 . . . . 0.0 109.157 -169.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -73.55 101.44 3.57 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -124.23 141.95 51.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.12 100.59 10.06 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 126.364 1.866 . . . . 0.0 106.715 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.2 t -108.35 148.43 30.09 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 164.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.38 -162.13 12.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 106.799 -2.52 . . . . 0.0 106.799 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HB3' ' A' ' 73' ' ' ARG . 77.0 t80 -108.37 -11.99 15.11 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -171.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.2 m 51.52 -164.96 0.05 Allowed 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 129.886 3.274 . . . . 0.0 111.601 -172.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.49 -30.23 33.39 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.444 1.497 . . . . 0.0 113.247 172.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.0 t -174.91 0.06 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.486 0.715 . . . . 0.0 112.258 162.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -125.68 102.74 7.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 123.665 1.698 . . . . 0.0 109.575 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HB3' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -55.5 132.44 48.49 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.945 -171.853 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.07 165.14 12.65 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 128.153 2.581 . . . . 0.0 109.446 -164.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.5 mtm -152.45 156.59 39.77 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.512 -2.033 . . . . 0.0 105.512 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.69 175.83 30.06 Favored Glycine 0 C--N 1.318 -0.44 0 C-N-CA 124.607 1.099 . . . . 0.0 110.397 173.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.4 m -87.48 165.24 15.67 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 122.092 -0.652 . . . . 0.0 110.927 -173.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -145.96 178.33 8.27 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -159.07 155.89 28.21 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.073 1.749 . . . . 0.0 109.569 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mp -112.31 127.08 55.89 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 125.512 1.525 . . . . 0.0 107.754 175.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 169.36 15.01 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 124.795 1.238 . . . . 0.0 109.317 171.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.6 t0 44.66 44.88 7.77 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.739 1.616 . . . . 0.0 113.477 168.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.82 0.66 5.39 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 115.585 0.994 . . . . 0.0 115.585 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -127.33 172.2 10.84 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 126.227 1.811 . . . . 0.0 112.013 -166.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.03 103.31 9.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -174.169 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -90.86 151.51 21.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.47 ' HB3' HD21 ' A' ' 90' ' ' LEU . 82.5 m-85 -118.08 -179.83 3.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 123.485 0.714 . . . . 0.0 110.698 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -107.61 -105.32 3.0 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 176.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 m -140.91 71.62 1.37 Allowed 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 -169.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.626 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -63.33 167.04 5.64 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.528 0.68 . . . . 0.0 111.033 -177.698 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.79 170.95 26.08 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 107.711 -2.155 . . . . 0.0 107.711 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -155.42 -156.08 7.62 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -160.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.4 p -76.88 -179.69 5.61 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 122.255 -0.556 . . . . 0.0 109.622 165.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -133.68 86.98 2.33 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 163.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 10.0 mtt -80.52 154.46 27.51 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.47 140.39 58.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 159.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 98.9 m -142.71 -19.27 0.67 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.481 1.113 . . . . 0.0 113.392 172.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.0 mtm 62.18 25.57 15.31 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.38 1.072 . . . . 0.0 113.739 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -123.81 161.56 45.81 Favored Pre-proline 0 C--O 1.24 0.562 0 C-N-CA 125.909 1.683 . . . . 0.0 110.233 -176.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.27 -33.0 19.42 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.68 2.253 . . . . 0.0 111.231 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -60.14 -33.75 81.07 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.967 0.794 . . . . 0.0 111.524 172.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.92 -43.19 99.65 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 118.076 0.938 . . . . 0.0 112.42 172.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -85.85 -33.25 21.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.138 0.969 . . . . 0.0 112.895 -170.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 17.6 tt -61.01 -18.29 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 118.819 0.736 . . . . 0.0 111.599 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -56.96 -36.21 70.02 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 121.352 -0.842 . . . . 0.0 111.858 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.86 -26.55 60.7 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.282 -0.732 . . . . 0.0 112.414 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.26 -40.17 15.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 118.697 1.249 . . . . 0.0 110.601 173.651 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -30.54 57.07 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 -158.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.1 mt -60.41 -38.94 85.6 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.808 1.243 . . . . 0.0 110.068 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -36.95 67.34 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 122.782 0.433 . . . . 0.0 110.361 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.95 66.09 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 122.083 -0.385 . . . . 0.0 111.288 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.88 -7.32 39.25 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.12 -0.943 . . . . 0.0 113.349 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.7 p -94.77 -11.68 28.54 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 120.789 1.631 . . . . 0.0 112.317 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -113.54 35.31 4.08 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.169 0.987 . . . . 0.0 110.782 -172.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 mm -72.15 72.96 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -75.92 -35.15 59.86 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 169.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -127.54 160.71 30.69 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.138 0.975 . . . . 0.0 110.731 -173.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -151.35 158.11 43.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.604 1.162 . . . . 0.0 107.961 169.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.51 108.37 0.44 Allowed Glycine 0 N--CA 1.441 -1.018 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 172.504 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.4 p -108.5 156.19 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 118.936 1.368 . . . . 0.0 111.174 169.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -136.92 112.07 9.06 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 39.5 ttm -108.45 66.99 0.65 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.514 1.526 . . . . 0.0 109.385 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -152.69 80.6 1.22 Allowed 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.789 1.236 . . . . 0.0 109.458 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -27.88 119.94 0.26 Allowed Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 127.697 2.399 . . . . 0.0 112.437 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.56 122.72 8.81 Favored 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.317 0.792 . . . . 0.0 111.758 15.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -83.28 141.91 31.49 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -172.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -141.53 170.13 16.31 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 161.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -143.22 142.34 31.38 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 127.732 2.413 . . . . 0.0 105.226 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.15 129.08 33.27 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 -174.23 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 97.1 mt -103.86 140.4 37.72 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.7 t -127.22 123.67 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.94 165.2 25.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -59.66 -33.15 71.18 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.578 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.05 -21.88 39.74 Favored 'General case' 0 C--N 1.341 0.207 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.406 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.15 6.45 12.26 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.37 -1.239 . . . . 0.0 115.407 168.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 35' ' ' GLN . 1.4 m-20 -61.68 133.64 55.83 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.587 2.193 . . . . 0.0 108.72 174.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.4 m -116.33 103.36 10.4 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.845 2.058 . . . . 0.0 108.265 -169.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.8 mp -94.55 114.18 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 51.1 m -86.03 124.31 32.32 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 170.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -99.35 163.4 12.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.484 1.514 . . . . 0.0 108.621 167.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.38 147.64 34.76 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.089 1.756 . . . . 0.0 108.279 163.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.2 tpt85 -81.15 109.41 15.67 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.8 t -91.27 108.52 19.94 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 105.03 -2.211 . . . . 0.0 105.03 163.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.77 16.77 17.33 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.693 2.397 . . . . 0.0 110.69 165.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.188 0 CA-C-O 116.52 -1.705 . . . . 0.0 107.126 164.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 . . . . . 0 C--O 1.237 0.418 0 CA-C-O 121.685 0.755 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -94.25 144.63 28.33 Favored Pre-proline 0 C--O 1.232 0.152 0 CA-C-N 115.378 -0.828 . . . . 0.0 113.128 -166.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.1 -28.47 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.669 2.246 . . . . 0.0 111.689 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.78 -21.14 64.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.77 0.828 . . . . 0.0 112.934 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.513 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.96 -16.67 57.98 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.221 -0.925 . . . . 0.0 111.71 176.135 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.536 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.2 t -72.79 -21.01 61.06 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.842 1.201 . . . . 0.0 110.451 -168.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -75.76 3.4 9.9 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 120.01 -1.681 . . . . 0.0 110.743 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -121.56 29.2 7.31 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.095 2.158 . . . . 0.0 109.348 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 120' ' ' VAL . 3.8 mm? -103.09 74.1 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.905 2.082 . . . . 0.0 105.896 167.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.256 2.0 p30 -129.44 -62.54 0.97 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.353 -172.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 2.12 45.2 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.415 1.486 . . . . 0.0 110.804 171.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.99 162.18 29.84 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.698 1.999 . . . . 0.0 109.57 -171.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.1 m -156.08 144.12 19.75 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 118.589 -2.569 . . . . 0.0 107.701 -173.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TRP . . . . . 0.468 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 28.2 m95 -149.02 175.79 11.0 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 124.171 0.92 . . . . 0.0 112.192 -161.05 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.597 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.6 p -153.65 118.63 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 174.311 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.587 HD11 HD12 ' A' ' 138' ' ' LEU . 7.5 tp -60.41 139.12 57.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.124 -175.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 t -145.63 -2.17 0.76 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 113.274 171.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.43 157.35 42.93 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.036 1.289 . . . . 0.0 110.281 168.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TRP . . . . . 0.551 ' CD1' HD21 ' A' ' 138' ' ' LEU . 2.2 t90 -152.56 100.39 2.55 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 127.098 2.159 . . . . 0.0 105.829 172.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.66 142.84 27.93 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -81.99 170.94 14.99 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 164.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.26 72.36 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 123.574 0.546 . . . . 0.0 111.502 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -86.08 3.13 43.87 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.802 1.641 . . . . 0.0 112.054 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.93 1.14 57.29 Favored Glycine 0 CA--C 1.524 0.605 0 O-C-N 120.746 -1.222 . . . . 0.0 112.789 167.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.4 m -67.01 95.74 0.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 126.344 1.857 . . . . 0.0 109.407 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.77 112.4 2.01 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.958 -1.089 . . . . 0.0 109.759 165.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -71.7 149.6 45.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.378 1.071 . . . . 0.0 109.507 176.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.49 105.73 15.53 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 124.364 1.066 . . . . 0.0 109.164 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.9 m -113.51 152.26 45.19 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 125.872 1.669 . . . . 0.0 107.207 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -73.97 120.08 6.18 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 121.887 1.724 . . . . 0.0 109.034 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.24 171.11 13.61 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.216 0.606 . . . . 0.0 110.119 171.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -38.69 77.28 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 121.895 -0.503 . . . . 0.0 110.459 169.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -9.5 58.66 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -81.57 -29.69 33.31 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.864 0.866 . . . . 0.0 111.803 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.51 -80.01 0.24 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -170.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.07 85.23 58.24 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.163 1.385 . . . . 0.0 110.137 -168.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.47 152.44 75.1 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.187 1.925 . . . . 0.0 111.036 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.1 mt -78.03 101.7 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.9 177.78 6.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.225 1.375 . . . . 0.0 108.5 174.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HG ' ' CE2' ' A' ' 140' ' ' PHE . 1.4 tm? -144.23 146.85 32.92 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 127.031 2.133 . . . . 0.0 106.966 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -145.29 143.52 30.25 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 105.917 -1.882 . . . . 0.0 105.917 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.03 128.96 41.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 172.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -159.8 177.75 10.5 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -129.43 24.03 5.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.121 0.968 . . . . 0.0 112.574 -171.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.79 -31.44 11.67 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.1 p -92.95 8.05 41.42 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.123 177.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.83 -0.46 51.15 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.21 1.386 . . . . 0.0 111.908 -166.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -117.89 161.6 19.49 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 126.037 1.735 . . . . 0.0 108.622 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -75.56 63.47 1.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 124.709 1.203 . . . . 0.0 109.832 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.96 110.64 18.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 120.801 1.637 . . . . 0.0 110.187 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.66 152.5 27.09 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.668 -1.605 . . . . 0.0 107.257 159.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.5 p -141.94 -177.88 5.42 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 125.092 1.357 . . . . 0.0 107.964 161.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.16 168.39 39.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 163.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.461 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 5.7 t80 -89.75 138.35 31.56 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 160.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.5 t -118.71 71.44 0.85 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.01 -36.21 0.4 Allowed Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.975 2.226 . . . . 0.0 116.982 167.004 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 7.6 t -146.49 -14.26 0.44 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.199 1.399 . . . . 0.0 111.893 163.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -130.06 115.52 17.22 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -64.5 162.46 15.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.519 164.363 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -139.09 168.45 19.81 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 125.341 1.457 . . . . 0.0 109.223 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.8 ptp -152.16 172.81 15.79 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.098 2.159 . . . . 0.0 108.185 170.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.3 -143.62 7.52 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.654 -2.178 . . . . 0.0 107.654 168.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.1 m -125.26 161.23 27.4 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 119.281 1.541 . . . . 0.0 112.777 165.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -128.62 173.62 10.13 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.228 1.011 . . . . 0.0 111.847 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -154.22 139.89 17.98 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.373 1.069 . . . . 0.0 110.349 -176.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.26 120.6 42.27 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 168.45 22.74 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.535 1.534 . . . . 0.0 109.226 169.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t0 48.31 39.06 11.55 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.065 1.346 . . . . 0.0 113.713 167.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.3 13.14 48.32 Favored Glycine 0 CA--C 1.535 1.291 0 O-C-N 120.233 -1.542 . . . . 0.0 114.56 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -134.65 164.8 26.7 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 119.244 1.522 . . . . 0.0 113.01 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.0 tp -109.92 96.83 6.5 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.693 1.597 . . . . 0.0 106.812 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.3 m -87.43 162.3 17.36 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.419 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.3 m-85 -139.3 155.92 47.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.773 1.629 . . . . 0.0 109.166 -176.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.11 -106.6 0.15 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 170.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -143.83 58.84 1.37 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.232 1.015 . . . . 0.0 108.465 -154.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.706 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -60.45 153.11 23.94 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 121.142 -0.974 . . . . 0.0 112.913 -165.805 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.78 173.1 45.42 Favored Glycine 0 N--CA 1.453 -0.201 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -147.54 -117.29 0.97 Allowed Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.3 p -120.82 178.25 4.78 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.689 1.196 . . . . 0.0 110.928 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.6 mtt85 -113.43 73.51 0.82 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.274 1.03 . . . . 0.0 108.68 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtt -74.58 176.99 6.37 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.038 -1.039 . . . . 0.0 109.342 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.43 147.74 52.39 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.55 1.14 . . . . 0.0 109.679 173.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 9.9 m -136.41 -12.62 1.83 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.17 1.788 . . . . 0.0 114.211 177.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 66.03 22.11 11.22 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.856 1.663 . . . . 0.0 113.36 176.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.2 p -110.41 165.3 12.93 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 124.009 0.924 . . . . 0.0 111.191 -165.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.92 -11.46 25.6 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.533 2.155 . . . . 0.0 112.768 164.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -93.05 -9.82 60.37 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-N 118.983 0.811 . . . . 0.0 112.881 168.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.11 -53.44 9.21 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 119.19 1.495 . . . . 0.0 112.487 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -88.2 -16.18 34.0 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -167.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.99 -17.98 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.296 170.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -44.75 -55.18 5.53 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.002 1.321 . . . . 0.0 110.06 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.63 -6.14 70.6 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.002 -0.888 . . . . 0.0 113.742 -173.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -87.08 -51.79 5.8 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.835 1.817 . . . . 0.0 109.005 162.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.84 -47.62 76.91 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.799 1.24 . . . . 0.0 111.416 -171.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.98 -44.39 91.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.059 0.391 . . . . 0.0 110.388 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.44 -34.09 76.1 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.548 0.739 . . . . 0.0 111.624 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.14 59.89 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.95 0.9 . . . . 0.0 112.564 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -72.94 -8.21 54.6 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.475 1.034 . . . . 0.0 112.257 172.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 13.7 p -83.75 -5.07 59.11 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.191 -0.943 . . . . 0.0 111.768 175.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -127.33 83.33 2.16 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.064 2.146 . . . . 0.0 107.283 -169.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -122.18 59.41 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.228 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.41 -22.88 62.68 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.895 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -135.09 165.76 24.62 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.767 1.627 . . . . 0.0 111.095 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 11.2 m -159.93 170.17 21.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.757 1.623 . . . . 0.0 109.019 176.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.06 83.42 0.13 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 125.01 1.29 . . . . 0.0 110.037 168.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 23' ' ' LEU . 2.4 p -81.3 151.48 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.475 1.637 . . . . 0.0 109.898 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -127.0 90.84 3.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.701 1.6 . . . . 0.0 107.603 175.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 35.2 ttm -77.72 73.29 4.29 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.292 1.044 . . . . 0.0 109.25 169.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -151.45 143.42 23.88 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.574 -2.009 . . . . 0.0 105.574 162.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.07 133.44 95.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 119.72 1.145 . . . . 0.0 108.732 173.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -75.49 117.76 4.96 Favored 'Cis proline' 0 N--CA 1.455 -0.781 0 CA-C-N 120.289 1.139 . . . . 0.0 110.923 -2.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -71.21 132.51 45.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -172.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -144.08 163.23 34.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.234 1.014 . . . . 0.0 108.636 173.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.0 ttp -126.44 115.45 19.62 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -86.31 148.7 25.49 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 158.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.47 155.31 45.02 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 126.147 1.779 . . . . 0.0 106.455 167.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.2 t -141.45 125.67 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -174.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.14 165.6 24.67 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.11 -30.77 38.4 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 125.985 1.714 . . . . 0.0 111.843 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.14 -37.77 69.36 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.2 1.0 . . . . 0.0 109.019 -176.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.15 13.56 4.85 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.938 1.256 . . . . 0.0 113.873 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.12 156.36 5.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.174 1.987 . . . . 0.0 110.204 174.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.8 m -126.45 97.62 5.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.0 162.11 19.49 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.257 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 88.2 m -152.94 133.06 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.124 0.57 . . . . 0.0 109.565 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' PHE . . . . . 0.427 ' CE2' ' HG ' ' A' ' 54' ' ' LEU . 2.1 m-85 -126.31 156.01 41.08 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.597 1.559 . . . . 0.0 110.689 -176.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ASP . . . . . 0.597 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -91.62 156.85 17.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 117.12 -1.419 . . . . 0.0 107.279 176.19 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -81.82 91.94 6.59 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 122.613 2.461 . . . . 0.0 109.706 163.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 26.6 t -81.72 90.18 6.33 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 166.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 t -91.02 1.83 56.78 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 175.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 129.752 3.221 . . . . 0.0 114.035 -174.261 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 56.5 mt . . . . . 0 N--CA 1.472 0.635 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.86 -170.54 0.47 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.299 2.666 . . . . 0.0 109.912 167.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.5 170.89 11.14 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.619 -0.676 . . . . 0.0 110.204 173.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -53.85 160.79 1.97 Allowed Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.796 152.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -75.93 -14.99 19.01 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.582 2.855 . . . . 0.0 114.052 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.9 178.39 0.23 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.484 2.314 . . . . 0.0 110.669 -164.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 32.4 t -98.35 109.47 22.22 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 127.126 2.171 . . . . 0.0 110.243 -171.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -136.63 45.83 2.27 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.882 0.849 . . . . 0.0 112.327 171.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -150.58 110.01 3.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.119 -0.988 . . . . 0.0 109.091 -178.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.6 t -134.71 97.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 171.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -164.9 156.23 13.1 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 121.425 -0.797 . . . . 0.0 111.539 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.24 161.85 32.45 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 123.72 2.947 . . . . 0.0 111.728 176.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.8 158.61 70.39 Favored Pre-proline 0 C--O 1.242 0.663 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -175.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.84 -173.05 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 124.065 3.177 . . . . 0.0 111.838 -171.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 64.19 -178.25 0.16 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.664 1.586 . . . . 0.0 110.376 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -161.52 143.36 8.76 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 124.591 1.156 . . . . 0.0 108.916 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -80.95 -31.83 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.714 2.943 . . . . 0.0 111.844 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.2 56.8 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.349 1.059 . . . . 0.0 110.707 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.574 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -154.56 -41.18 0.09 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 129.69 3.196 . . . . 0.0 107.024 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -68.13 21.45 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.018 1.327 . . . . 0.0 113.766 177.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -120.34 1.48 10.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.668 2.787 . . . . 0.0 111.428 175.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mp -113.2 2.27 15.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 129.199 3.0 . . . . 0.0 109.341 175.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.5 mm? -81.51 67.71 7.57 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.628 1.571 . . . . 0.0 107.891 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.57 -48.52 0.76 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 122.975 0.51 . . . . 0.0 111.032 -173.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.12 65.75 0.92 Allowed 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.4 p -135.67 171.09 14.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.229 1.012 . . . . 0.0 109.592 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 m -156.12 148.91 24.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.335 -2.103 . . . . 0.0 107.557 -178.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -158.67 154.46 26.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -161.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -134.93 129.22 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -76.81 130.28 37.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 106.174 -1.788 . . . . 0.0 106.174 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -123.05 -16.39 7.03 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -156.58 147.29 21.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 119.423 1.01 . . . . 0.0 108.917 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -135.67 115.2 12.71 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.32 145.69 27.83 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.088 0.955 . . . . 0.0 109.453 174.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -79.45 167.07 21.31 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.918 0.487 . . . . 0.0 110.333 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.69 70.43 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.632 0.773 . . . . 0.0 112.909 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -85.39 -30.25 23.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.23 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 139.59 -0.74 2.25 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-O 118.434 -1.203 . . . . 0.0 115.065 176.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.5 m -64.79 108.64 1.8 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 120.822 2.311 . . . . 0.0 109.758 176.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.53 110.13 1.38 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.037 0.535 . . . . 0.0 109.737 165.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 42.7 mtt-85 -63.72 171.69 2.56 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.15 1.38 . . . . 0.0 110.106 173.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.84 127.08 43.55 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 m -129.8 155.23 80.79 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.605 0.762 . . . . 0.0 109.566 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.35 103.48 1.69 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.62 2.213 . . . . 0.0 110.257 178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.2 m -61.1 158.25 14.14 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 166.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.7 -17.13 62.67 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.172 0.989 . . . . 0.0 113.467 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -72.39 -12.07 60.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.641 0.655 . . . . 0.0 112.662 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.0 -22.04 18.8 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 -165.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.39 -9.42 8.28 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 164.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.78 76.21 3.83 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.418 1.887 . . . . 0.0 110.031 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.93 160.97 46.11 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 123.897 3.065 . . . . 0.0 111.678 -178.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -89.23 107.01 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 124.077 0.951 . . . . 0.0 109.313 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.1 p -112.39 154.33 25.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.914 1.286 . . . . 0.0 109.596 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.22 143.07 50.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 127.724 2.41 . . . . 0.0 106.627 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.2 m -137.3 128.57 27.97 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 68.0 mt -120.09 118.56 30.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 104.858 -2.275 . . . . 0.0 104.858 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -168.71 168.36 10.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -75.29 48.66 0.43 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.051 0.94 . . . . 0.0 110.636 168.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -69.93 -20.66 63.34 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 112.402 -171.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.2 p -98.21 -0.02 44.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.54 1.136 . . . . 0.0 111.459 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.44 -17.16 57.09 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.972 1.748 . . . . 0.0 111.955 -161.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -122.51 170.19 10.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.901 1.85 . . . . 0.0 110.87 -175.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -71.53 81.46 0.81 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 123.725 0.81 . . . . 0.0 109.913 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -126.32 113.4 16.88 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.86 1.264 . . . . 0.0 107.69 -170.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.64 148.63 51.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.534 169.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 p -147.19 165.67 29.31 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 125.084 1.354 . . . . 0.0 107.744 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 165.53 -174.75 41.32 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -122.66 113.98 19.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.3 m -125.57 94.41 4.13 Favored 'General case' 0 CA--C 1.516 -0.36 0 O-C-N 123.685 0.616 . . . . 0.0 110.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.0 -101.93 1.4 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 108.077 -2.009 . . . . 0.0 108.077 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -138.07 25.98 2.72 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.819 1.31 . . . . 0.0 111.187 164.325 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -140.79 128.48 21.57 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 -170.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -73.42 147.83 43.86 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.803 -0.561 . . . . 0.0 110.304 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -123.72 169.32 11.63 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 125.143 1.377 . . . . 0.0 110.373 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -161.17 169.13 22.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.953 1.701 . . . . 0.0 109.189 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.21 173.62 25.0 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.642 1.591 . . . . 0.0 110.127 166.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.5 p -79.46 165.45 23.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.275 1.038 . . . . 0.0 111.021 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.3 p90 -140.34 174.54 10.41 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.154 0.582 . . . . 0.0 111.449 172.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.73 150.82 26.61 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.612 1.565 . . . . 0.0 109.072 174.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.67 128.55 55.33 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 123.887 0.875 . . . . 0.0 108.829 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.7 ptpt -164.14 162.22 22.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.35 1.86 . . . . 0.0 109.002 173.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 52.2 22.55 1.99 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.579 2.352 . . . . 0.0 114.749 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.62 12.79 84.11 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-O 118.388 -1.229 . . . . 0.0 112.973 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -124.98 171.01 10.56 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.588 1.555 . . . . 0.0 112.47 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.583 ' O ' HG21 ' A' ' 115' ' ' ILE . 50.7 tp -109.94 100.14 9.14 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.832 1.653 . . . . 0.0 107.237 175.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 m -79.22 155.98 28.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.471 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.7 m-85 -120.36 159.13 25.67 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.44 0.696 . . . . 0.0 109.802 173.177 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.9 -155.95 30.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.7 m -63.17 95.6 0.09 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.523 1.129 . . . . 0.0 108.965 166.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 112' ' ' LEU . 19.5 mt -79.41 175.46 10.58 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 126.281 1.832 . . . . 0.0 110.571 168.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.88 177.33 33.9 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 168.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.25 -132.18 1.97 Allowed Glycine 0 CA--C 1.522 0.508 0 CA-C-O 118.234 -1.314 . . . . 0.0 110.291 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.3 p -143.78 156.2 44.42 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.147 1.779 . . . . 0.0 111.032 -173.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -103.55 61.29 0.76 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 122.146 0.974 . . . . 0.0 108.526 -163.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 18.7 mtm -71.03 172.12 9.66 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 167.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -131.73 124.81 30.52 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.544 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 6.3 m -118.16 8.39 12.35 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 117.317 -1.325 . . . . 0.0 113.067 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 25.4 ptp 44.67 41.14 4.66 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.208 1.803 . . . . 0.0 113.869 173.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.01 156.15 65.26 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.09 0.956 . . . . 0.0 109.838 -167.121 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.24 -36.92 6.47 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.211 2.608 . . . . 0.0 110.924 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.26 -3.97 89.82 Favored Glycine 0 C--O 1.219 -0.834 0 CA-C-O 117.436 -1.758 . . . . 0.0 111.289 174.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -85.47 -61.06 1.74 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-N 120.897 2.349 . . . . 0.0 111.888 170.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.99 -18.4 63.24 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -172.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -61.26 -8.01 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.976 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -44.42 -48.73 9.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 119.276 0.944 . . . . 0.0 111.073 162.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.94 -52.38 52.61 Favored Glycine 0 C--N 1.337 0.595 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.82 -43.95 97.83 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.517 0.727 . . . . 0.0 110.631 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -62.17 -48.43 80.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.29 1.036 . . . . 0.0 109.944 -173.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.0 mt -59.83 -37.21 78.57 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.312 0.505 . . . . 0.0 110.741 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -16.75 64.38 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.34 -7.17 32.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.064 1.345 . . . . 0.0 111.618 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 90' ' ' LEU . 91.0 mt -83.67 -13.39 54.25 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.181 1.355 . . . . 0.0 111.66 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -5.06 59.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.43 1.092 . . . . 0.0 113.445 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -134.33 78.58 1.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.421 1.089 . . . . 0.0 108.408 -171.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.583 HG21 ' O ' ' A' ' 85' ' ' LEU . 27.5 mm -103.71 35.6 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.081 1.352 . . . . 0.0 110.337 -172.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -23.35 67.18 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.527 -1.983 . . . . 0.0 113.605 -164.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -124.5 158.3 33.23 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.156 1.382 . . . . 0.0 109.025 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 51.6 m -155.56 124.83 6.25 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.051 -1.031 . . . . 0.0 110.943 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -101.61 131.15 10.48 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 127.311 2.386 . . . . 0.0 110.383 171.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' A' ' 19' ' ' ALA . 1.7 p -137.48 138.29 44.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 O-C-N 120.223 -1.751 . . . . 0.0 107.974 159.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.85 97.25 5.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 169.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.505 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 29.7 mtp -76.73 -5.51 48.37 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 127.06 30.29 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.578 1.551 . . . . 0.0 108.599 158.431 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.0 137.97 53.39 Favored Pre-proline 0 N--CA 1.445 -0.72 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -83.45 110.21 1.77 Allowed 'Cis proline' 0 CA--C 1.536 0.615 0 CA-C-N 120.615 1.255 . . . . 0.0 111.675 9.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 122' ' ' MET . 79.7 mt-30 -68.66 129.67 40.62 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.93 1.292 . . . . 0.0 111.374 -164.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -141.26 112.1 7.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.549 0.69 . . . . 0.0 109.449 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 56.4 ttp -75.96 157.09 33.54 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.1 112.0 5.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 121.381 -0.824 . . . . 0.0 109.596 177.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 79.2 mt -86.72 156.78 19.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.1 t -142.72 137.81 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.49 167.35 10.67 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -62.08 -19.92 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.008 1.323 . . . . 0.0 113.327 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.33 -32.55 60.96 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.003 0.82 . . . . 0.0 109.865 172.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.63 0.51 20.04 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 117.84 -1.534 . . . . 0.0 113.425 -165.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.37 159.07 13.18 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.025 1.913 . . . . 0.0 108.784 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 m -138.45 141.07 39.5 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.666 1.121 . . . . 0.0 109.088 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -132.78 111.39 11.07 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 120.423 -1.423 . . . . 0.0 108.179 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.3 m -88.47 118.65 28.26 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 124.94 1.296 . . . . 0.0 110.238 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -110.25 139.77 45.09 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.891 0.876 . . . . 0.0 110.742 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.99 153.99 33.97 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 160.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -69.75 147.49 50.41 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 158.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 1.6 t -138.81 101.39 4.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 p -81.31 -5.27 57.64 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 . . . . . 0 C--O 1.254 1.301 0 CA-C-O 117.105 -1.426 . . . . 0.0 111.144 -142.178 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.465 0.296 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -69.67 158.49 56.89 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.547 2.165 . . . . 0.0 110.374 168.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt 174.57 167.52 0.25 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 130.735 3.614 . . . . 0.0 105.789 167.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.1 m80 63.3 166.62 0.11 Allowed Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 123.972 0.909 . . . . 0.0 112.099 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -67.89 78.53 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.087 1.858 . . . . 0.0 108.304 166.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.15 -174.47 4.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.003 1.721 . . . . 0.0 107.877 -167.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.0 p -79.85 -166.77 1.07 Allowed 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.993 -1.067 . . . . 0.0 113.159 -173.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 65.99 29.68 10.04 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.211 1.804 . . . . 0.0 113.758 -177.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -124.11 39.7 3.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.132 0.973 . . . . 0.0 112.622 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.62 129.82 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 56.61 165.91 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.893 1.677 . . . . 0.0 114.472 -171.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -64.81 149.03 90.24 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 N-CA-C 108.771 -1.28 . . . . 0.0 108.771 153.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.56 165.16 51.73 Favored Pre-proline 0 C--O 1.24 0.604 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -68.87 -165.57 0.14 Allowed 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.719 2.946 . . . . 0.0 111.007 173.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 55.58 71.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.931 1.292 . . . . 0.0 112.663 162.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -125.13 144.04 46.09 Favored Pre-proline 0 N--CA 1.474 0.772 0 O-C-N 121.405 -0.809 . . . . 0.0 112.621 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.06 -23.17 18.6 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.711 2.941 . . . . 0.0 111.977 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.45 -25.72 2.8 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.198 1.399 . . . . 0.0 113.729 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.72 -2.38 57.01 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.065 -1.022 . . . . 0.0 113.311 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 m -56.03 -59.04 5.48 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 119.168 0.895 . . . . 0.0 110.44 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -59.16 -14.96 12.09 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -177.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.3 -5.62 58.69 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 118.714 0.688 . . . . 0.0 109.573 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.96 -11.85 61.09 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 120.844 -1.16 . . . . 0.0 112.418 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.07 -8.12 46.84 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -167.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -138.18 62.72 1.56 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.486 1.914 . . . . 0.0 106.61 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.2 p -141.34 -176.13 4.6 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 120.611 -1.306 . . . . 0.0 110.97 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 8.1 m -144.81 -60.08 0.36 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.901 176.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 7.1 m95 68.68 159.54 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.128 1.371 . . . . 0.0 112.217 -176.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 t -136.61 129.38 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.541 HD11 HD12 ' A' ' 138' ' ' LEU . 52.1 tp -67.75 151.18 47.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 t -144.46 -23.36 0.53 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.06 146.13 29.9 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 121.202 1.819 . . . . 0.0 110.188 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.696 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.8 t90 -135.66 110.84 8.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.8 139.19 34.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -64.68 -170.17 0.05 OUTLIER 'General case' 0 C--O 1.237 0.436 0 CA-C-N 118.729 0.695 . . . . 0.0 110.559 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.71 -28.91 65.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.276 -1.515 . . . . 0.0 113.521 174.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -81.81 -45.47 15.53 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 123.242 1.496 . . . . 0.0 111.216 -165.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 140.81 -5.1 2.5 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 128.107 2.765 . . . . 0.0 112.709 -166.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -62.32 99.91 0.16 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.818 1.309 . . . . 0.0 109.689 167.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.73 122.29 12.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 159.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.7 156.05 35.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.82 146.56 53.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 162.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.6 m -141.31 156.29 67.45 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 161.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.608 1.539 . . . . 0.0 109.307 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.08 159.44 11.74 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.52 -1.363 . . . . 0.0 108.739 163.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.776 0.43 . . . . 0.0 111.552 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -19.78 66.05 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -65.86 -16.31 63.71 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.231 0.612 . . . . 0.0 112.638 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.29 -45.77 0.88 Allowed Glycine 0 C--N 1.337 0.628 0 C-N-CA 125.518 1.533 . . . . 0.0 111.174 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 68' ' ' PHE . . . -157.39 86.7 2.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.565 -155.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.07 161.27 46.6 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.814 2.343 . . . . 0.0 111.634 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.3 mt -80.36 108.48 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 125.539 1.536 . . . . 0.0 109.05 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.2 p -91.85 169.79 10.4 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 122.178 0.989 . . . . 0.0 110.649 172.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -130.58 167.33 18.89 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 161.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 10.7 m -145.64 133.6 21.36 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 170.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.4 mt -133.0 82.15 1.98 Allowed 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 t -150.23 -154.97 0.59 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.942 1.297 . . . . 0.0 107.755 175.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.3 p -128.78 43.37 3.16 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.293 1.437 . . . . 0.0 111.993 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.8 t -57.16 -41.84 79.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.466 -1.396 . . . . 0.0 112.461 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -76.75 -31.62 57.21 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 120.415 -1.428 . . . . 0.0 110.259 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 124.19 -23.86 6.39 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 127.986 2.708 . . . . 0.0 111.243 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -82.44 165.33 20.32 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.693 1.246 . . . . 0.0 109.079 170.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -74.37 80.13 1.88 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -117.33 155.89 28.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 120.365 -1.46 . . . . 0.0 111.07 171.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.66 144.33 28.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 p -150.63 65.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 122.514 1.149 . . . . 0.0 110.23 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -103.57 -175.98 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.272 0.939 . . . . 0.0 111.394 -172.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 35.9 t80 -109.35 119.42 39.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 168.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.05 168.78 10.4 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 171.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.89 -42.73 8.0 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 -144.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 49.4 t -129.38 -5.96 4.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.596 1.198 . . . . 0.0 112.67 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -131.6 123.19 27.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.3 mtt-85 -56.98 169.77 0.49 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.088 0.555 . . . . 0.0 111.863 177.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -142.19 156.21 45.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.832 175.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -154.15 155.54 35.52 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.763 1.225 . . . . 0.0 109.206 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.75 -98.32 0.11 Allowed Glycine 0 C--O 1.228 -0.273 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 7.9 m -162.75 154.28 17.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.097 1.759 . . . . 0.0 108.017 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 7.4 p90 -139.11 167.55 21.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.462 1.028 . . . . 0.0 111.519 169.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.76 143.05 26.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.651 1.18 . . . . 0.0 108.298 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.64 116.35 28.97 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 166.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -150.99 162.06 41.55 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.811 1.245 . . . . 0.0 107.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 56.14 26.32 10.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.352 1.461 . . . . 0.0 113.612 166.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.83 21.08 65.0 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.463 -1.187 . . . . 0.0 112.814 -175.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.551 ' HA ' HG21 ' A' ' 118' ' ' THR . 16.7 pttp -135.93 166.78 22.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.389 1.594 . . . . 0.0 112.18 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.28 145.12 44.24 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 164.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -141.6 161.85 36.91 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.175 -0.953 . . . . 0.0 108.762 167.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 90.6 m-85 -130.67 164.04 25.89 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.353 0.661 . . . . 0.0 111.107 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.05 -151.68 26.89 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 125.171 1.367 . . . . 0.0 110.051 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 t -66.66 121.23 14.93 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 171.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -111.26 166.84 10.75 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.569 1.948 . . . . 0.0 110.852 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 163.86 -167.48 37.96 Favored Glycine 0 CA--C 1.523 0.574 0 O-C-N 121.774 -0.579 . . . . 0.0 111.784 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -178.86 -156.79 18.05 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 126.164 1.84 . . . . 0.0 109.209 -176.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.7 t -90.8 170.37 10.16 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.667 1.233 . . . . 0.0 108.768 160.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.2 mtm180 -118.06 85.56 2.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 164.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.1 mtm -82.2 154.45 25.44 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.41 122.79 30.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 57.4 m -123.86 -32.57 3.27 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 123.809 0.844 . . . . 0.0 111.761 -170.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 16.9 ptp 45.88 56.05 6.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.909 1.684 . . . . 0.0 111.854 -175.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.7 p -144.07 159.59 52.31 Favored Pre-proline 0 C--O 1.238 0.471 0 C-N-CA 124.079 0.952 . . . . 0.0 110.847 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.29 -29.57 13.91 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.765 2.31 . . . . 0.0 111.657 174.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.14 -7.08 84.23 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.316 -0.865 . . . . 0.0 111.102 167.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.95 -42.67 4.64 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 120.202 2.001 . . . . 0.0 111.549 173.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.66 -19.19 61.47 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 121.518 -0.989 . . . . 0.0 112.89 -172.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.6 tt -65.35 -15.86 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.516 1.126 . . . . 0.0 113.333 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.9 -50.12 19.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.736 1.214 . . . . 0.0 111.076 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.28 -19.56 71.61 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.634 -0.666 . . . . 0.0 113.228 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.3 -50.89 23.54 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.721 1.261 . . . . 0.0 108.307 169.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -63.09 -48.49 78.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.4 0.68 . . . . 0.0 110.252 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 30.3 mt -60.37 -27.74 67.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.031 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -68.2 -55.59 11.72 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.57 0.623 . . . . 0.0 109.61 171.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.89 69.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.671 1.189 . . . . 0.0 112.46 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.6 mt -65.58 -3.37 4.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.854 0.862 . . . . 0.0 113.215 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 65.9 p -102.42 11.65 37.69 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.519 1.054 . . . . 0.0 111.822 169.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -135.69 43.77 2.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.793 1.637 . . . . 0.0 110.656 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 115' ' ' ILE . 4.1 mp -79.97 91.33 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 O-C-N 119.478 -2.014 . . . . 0.0 105.72 159.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.84 -27.83 24.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 168.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.524 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -147.19 165.84 28.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.389 2.676 . . . . 0.0 114.016 -172.361 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.551 HG21 ' HA ' ' A' ' 84' ' ' LYS . 12.1 t -161.0 163.62 31.57 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.994 1.318 . . . . 0.0 108.792 -178.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.62 92.24 0.2 Allowed Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 108.394 -1.883 . . . . 0.0 108.394 172.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 93.0 t -80.73 125.22 39.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 119.412 1.606 . . . . 0.0 108.774 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.74 85.7 2.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.656 1.582 . . . . 0.0 107.933 -174.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -11.88 59.92 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.927 1.291 . . . . 0.0 113.74 -175.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.85 138.4 42.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.904 1.281 . . . . 0.0 109.01 160.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 150.87 97.55 Favored Pre-proline 0 N--CA 1.445 -0.692 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 164.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.28 119.73 4.5 Favored 'Cis proline' 0 N--CA 1.456 -0.721 0 N-CA-C 109.087 -1.159 . . . . 0.0 109.087 -12.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -62.59 132.01 50.94 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.566 0.747 . . . . 0.0 110.857 -167.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -143.1 170.9 14.85 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.182 1.393 . . . . 0.0 109.8 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 42.5 ttp -139.88 118.28 12.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.071 1.348 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -79.18 150.71 31.61 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 158.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 96.3 mt -116.78 147.78 41.77 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 153.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.524 ' HB ' ' HG3' ' A' ' 117' ' ' ARG . 58.4 t -124.76 131.07 73.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 171.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 10.9 mp -78.68 160.53 27.45 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -48.67 -36.63 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.877 -1.511 . . . . 0.0 112.38 171.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -80.49 -14.43 58.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.799 0.84 . . . . 0.0 110.27 -173.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 109.64 0.77 30.73 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.352 0.977 . . . . 0.0 114.183 -174.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.46 153.39 35.56 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.99 1.395 . . . . 0.0 109.563 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.5 m -132.25 104.5 6.79 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.754 -0.591 . . . . 0.0 109.925 -167.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.696 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.4 mm? -104.91 150.98 24.42 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 30' ' ' LEU . 46.5 m -141.76 123.96 15.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.058 0.943 . . . . 0.0 109.716 -167.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 5.2 m-85 -122.41 139.49 53.78 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.69 1.596 . . . . 0.0 109.438 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.22 147.34 29.01 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.447 1.499 . . . . 0.0 108.536 168.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 101.24 6.62 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 120.671 -1.268 . . . . 0.0 109.457 168.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t -84.48 118.36 24.25 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 148.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.0 m -138.53 65.19 1.47 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.353 1.861 . . . . 0.0 106.462 152.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 126.853 2.061 . . . . 0.0 107.285 168.074 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 117.711 -1.138 . . . . 0.0 108.084 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.17 148.0 74.01 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.445 2.097 . . . . 0.0 110.999 -173.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -130.0 57.97 1.67 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.437 1.895 . . . . 0.0 108.145 -172.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 65.37 163.07 0.12 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.501 1.921 . . . . 0.0 112.24 -176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -70.32 -6.76 19.62 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 121.78 1.653 . . . . 0.0 113.469 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 71.3 175.71 0.29 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 128.675 2.79 . . . . 0.0 111.108 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.1 m -126.87 -178.96 4.59 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 127.832 2.453 . . . . 0.0 109.236 -168.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 44.45 56.15 5.21 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 127.457 2.303 . . . . 0.0 115.401 166.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.49 108.21 5.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.315 1.046 . . . . 0.0 108.293 174.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m -115.38 104.38 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.487 1.515 . . . . 0.0 109.201 171.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -146.85 160.84 39.55 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.763 1.225 . . . . 0.0 110.042 167.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -72.93 164.35 35.81 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 122.935 2.424 . . . . 0.0 110.865 170.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.48 148.1 62.57 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.077 1.351 . . . . 0.0 107.71 -179.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -65.95 -169.79 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 124.886 3.724 . . . . 0.0 113.432 167.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 73.58 163.33 0.27 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 128.896 2.878 . . . . 0.0 111.004 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -150.17 144.5 17.61 Favored Pre-proline 0 N--CA 1.435 -1.177 0 O-C-N 120.35 -1.469 . . . . 0.0 111.382 177.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.04 -41.0 10.56 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.825 2.35 . . . . 0.0 110.73 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.03 22.21 0.11 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.911 1.284 . . . . 0.0 112.289 175.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.55 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -103.08 -27.35 12.63 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 119.626 1.103 . . . . 0.0 111.832 160.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.0 m -70.91 -21.75 62.33 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.018 1.327 . . . . 0.0 112.998 -171.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -22.15 4.37 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.443 1.897 . . . . 0.0 113.445 165.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 mt -107.19 50.65 0.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.561 -171.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.3 mt -121.66 21.65 10.77 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.238 1.415 . . . . 0.0 110.27 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.39 -11.12 41.47 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.237 -0.915 . . . . 0.0 112.356 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -128.79 -6.63 5.07 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -83.06 -177.78 6.88 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.608 1.163 . . . . 0.0 112.833 -166.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -136.83 -64.87 0.57 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.056 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 66.28 162.5 0.16 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.012 1.725 . . . . 0.0 113.581 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.4 t -139.82 146.93 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -97.06 133.45 41.71 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.65 -3.76 1.85 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.61 149.81 27.03 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.925 1.239 . . . . 0.0 112.171 166.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.754 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.6 t90 -137.55 132.67 33.51 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.328 2.651 . . . . 0.0 108.154 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.33 147.15 46.06 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.124 1.769 . . . . 0.0 109.405 174.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -90.85 178.13 6.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.901 0.319 . . . . 0.0 110.301 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.52 69.35 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.966 0.506 . . . . 0.0 112.318 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -100.2 18.95 17.42 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.052 0.454 . . . . 0.0 110.793 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.6 8.83 79.74 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.018 -1.676 . . . . 0.0 112.268 170.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -66.41 100.98 0.69 Allowed 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 125.728 1.611 . . . . 0.0 108.181 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.4 106.11 1.64 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.457 1.026 . . . . 0.0 109.882 168.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -64.7 156.06 31.54 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.572 0.749 . . . . 0.0 110.183 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 142.46 54.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 167.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.5 m -144.23 159.52 52.06 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 125.656 1.583 . . . . 0.0 108.039 168.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -75.21 115.1 4.16 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.998 2.465 . . . . 0.0 110.435 171.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 166.83 12.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.49 1.916 . . . . 0.0 109.34 166.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.25 -52.42 65.67 Favored 'General case' 0 C--O 1.23 0.07 0 O-C-N 121.87 -0.519 . . . . 0.0 111.44 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -8.4 26.17 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.33 -15.41 50.14 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 120.892 -1.13 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.66 -81.27 0.27 Allowed Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.45 85.48 7.21 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 125.497 1.519 . . . . 0.0 107.998 -174.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -67.73 164.07 32.77 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.829 2.353 . . . . 0.0 110.443 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 70' ' ' GLY . 41.0 mt -79.85 107.03 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.3 p -113.43 129.95 56.42 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.3 tp -95.43 155.34 16.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.783 1.633 . . . . 0.0 106.598 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m -144.76 118.52 9.25 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.8 mt -117.12 85.59 2.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 -174.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.38 172.45 12.93 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.799 0.84 . . . . 0.0 110.231 -172.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.0 p -103.1 24.58 10.61 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.664 1.586 . . . . 0.0 112.873 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.94 -47.09 52.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.701 1.591 . . . . 0.0 112.616 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -74.6 3.03 8.43 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 118.995 0.816 . . . . 0.0 112.995 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.92 -27.36 20.78 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 127.388 2.423 . . . . 0.0 111.829 -171.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -120.27 152.7 37.4 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 118.316 1.058 . . . . 0.0 111.16 -172.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.1 ptp85 -65.6 96.88 0.28 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.59 154.27 49.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.242 1.017 . . . . 0.0 109.204 170.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.55 111.75 23.51 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.947 -1.871 . . . . 0.0 105.947 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.1 p -124.58 86.61 2.59 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.139 1.376 . . . . 0.0 108.354 -169.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 168.13 24.91 Favored Glycine 0 N--CA 1.469 0.873 0 O-C-N 120.994 -1.066 . . . . 0.0 111.514 -163.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.401 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 22.8 t80 -95.31 102.43 14.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 123.846 0.858 . . . . 0.0 109.752 -177.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 p -93.28 99.27 11.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 119.161 0.891 . . . . 0.0 109.001 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.427 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 75.07 -70.36 1.82 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 124.497 1.046 . . . . 0.0 112.784 166.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 28.3 t -130.94 -14.27 3.51 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.858 1.263 . . . . 0.0 112.797 175.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -133.87 133.79 41.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -165.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 5.8 mtt180 -71.18 138.26 49.41 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 118.29 -1.364 . . . . 0.0 109.273 170.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -103.17 162.89 12.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.969 2.043 . . . . 0.0 109.409 168.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.96 161.61 41.97 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.752 2.021 . . . . 0.0 107.232 167.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -171.92 -108.92 0.22 Allowed Glycine 0 C--N 1.334 0.456 0 O-C-N 121.927 -0.483 . . . . 0.0 112.373 169.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.0 m -154.37 168.71 25.72 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 127.278 2.231 . . . . 0.0 106.795 166.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -142.48 171.56 13.89 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.088 0.555 . . . . 0.0 110.184 162.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -146.58 152.17 38.5 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.34 1.856 . . . . 0.0 107.868 170.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.8 128.39 45.9 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 172.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -164.23 164.36 22.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 125.732 1.613 . . . . 0.0 108.639 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.88 4.88 2.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.33 6.08 89.43 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 118.576 -1.124 . . . . 0.0 112.316 -166.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.4 pttp -123.24 168.27 12.66 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 126.34 1.856 . . . . 0.0 110.846 -173.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.64 135.45 35.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 169.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.29 131.48 55.76 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 165.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.413 ' CB ' HD11 ' A' ' 90' ' ' LEU . 98.3 m-85 -97.97 161.32 13.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.09 -147.9 16.83 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -57.59 99.99 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.532 0.733 . . . . 0.0 109.049 167.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.553 HD13 HD23 ' A' ' 112' ' ' LEU . 61.2 mt -98.24 142.8 29.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.069 1.348 . . . . 0.0 108.599 170.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.15 -177.01 48.32 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.08 -168.55 32.11 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -172.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.9 p -75.61 173.32 11.2 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.988 2.515 . . . . 0.0 112.468 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -122.02 84.2 2.22 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 126.12 1.768 . . . . 0.0 108.899 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 11.0 mtt -73.68 -174.48 1.77 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.21 1.404 . . . . 0.0 108.155 159.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -142.63 109.77 5.59 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 120.824 1.647 . . . . 0.0 111.658 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 68.2 m -93.98 -14.79 25.52 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.764 -1.112 . . . . 0.0 112.442 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp 47.34 28.12 1.01 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.973 1.709 . . . . 0.0 114.824 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -117.57 164.33 19.94 Favored Pre-proline 0 C--O 1.239 0.513 0 C-N-CA 126.432 1.893 . . . . 0.0 109.936 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.92 -14.85 26.5 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.244 1.963 . . . . 0.0 113.788 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.31 -2.26 74.01 Favored Glycine 0 C--O 1.222 -0.604 0 CA-C-O 117.675 -1.625 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.75 -58.62 1.59 Allowed Glycine 0 C--N 1.337 0.587 0 CA-C-N 119.958 1.879 . . . . 0.0 112.803 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.07 -3.59 20.6 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -173.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -65.15 -10.48 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.135 0.974 . . . . 0.0 112.317 171.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -44.61 -60.68 1.87 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.265 1.426 . . . . 0.0 110.68 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.85 -30.11 77.1 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 118.501 -1.166 . . . . 0.0 112.333 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.45 -43.91 76.04 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.306 1.553 . . . . 0.0 109.845 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.72 -49.01 74.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.999 0.92 . . . . 0.0 109.758 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.39 -36.03 75.05 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.465 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -51.95 61.99 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.191 0.996 . . . . 0.0 110.123 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.79 -30.46 68.0 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.534 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.553 HD23 HD13 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -62.45 -22.11 65.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.379 1.472 . . . . 0.0 112.527 177.191 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.0 p -73.08 -27.51 61.76 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.544 -0.722 . . . . 0.0 111.157 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -114.96 49.57 1.04 Allowed 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 126.26 1.824 . . . . 0.0 110.05 -165.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.408 HD12 HD23 ' A' ' 130' ' ' LEU . 8.5 mm -75.41 69.15 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 166.339 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.64 -32.7 60.32 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 120.818 -1.176 . . . . 0.0 109.286 177.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -133.67 160.18 38.31 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.554 1.542 . . . . 0.0 110.366 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -155.47 166.5 33.35 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.131 -0.981 . . . . 0.0 109.886 -162.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.55 76.1 0.09 OUTLIER Glycine 0 CA--C 1.531 1.069 0 CA-C-N 118.61 0.641 . . . . 0.0 113.131 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.255 5.2 p -86.17 127.17 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.173 -1.781 . . . . 0.0 110.314 171.583 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -99.58 80.71 2.4 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.367 1.467 . . . . 0.0 107.041 173.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 27.8 ttm -82.18 63.38 6.36 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.843 1.656 . . . . 0.0 110.966 177.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -139.32 130.01 25.98 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 165.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.45 137.16 16.69 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 168.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.61 122.06 7.12 Favored 'Cis proline' 0 CA--C 1.542 0.876 0 CA-C-N 119.419 0.828 . . . . 0.0 111.383 -6.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -75.7 135.77 40.38 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.376 1.07 . . . . 0.0 110.93 -169.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -146.19 176.19 9.93 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 125.972 1.709 . . . . 0.0 108.839 165.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -141.7 134.09 28.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.076 1.75 . . . . 0.0 108.027 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -112.22 155.25 24.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 126.611 1.964 . . . . 0.0 109.329 172.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -138.78 155.39 48.22 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 127.127 2.171 . . . . 0.0 109.904 162.526 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.5 t -134.06 136.59 53.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 177.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -88.2 174.26 8.32 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 122.154 0.978 . . . . 0.0 111.287 -174.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -54.41 -39.71 67.55 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.619 1.968 . . . . 0.0 111.882 163.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -84.23 -20.81 31.64 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 126.491 1.916 . . . . 0.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 95.87 20.82 25.17 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-O 118.837 -0.98 . . . . 0.0 114.369 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.82 155.91 3.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.032 1.416 . . . . 0.0 108.729 163.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.06 110.55 11.71 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 126.037 1.735 . . . . 0.0 106.676 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.754 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -116.61 150.38 38.17 Favored 'General case' 0 CA--C 1.515 -0.366 0 O-C-N 121.451 -0.781 . . . . 0.0 109.239 -172.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 38.7 m -138.4 103.79 4.99 Favored 'General case' 0 C--O 1.239 0.541 0 O-C-N 124.277 0.986 . . . . 0.0 111.419 -162.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.469 ' HE1' HD11 ' A' ' 130' ' ' LEU . 96.2 m-85 -92.59 168.8 10.99 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.707 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.39 143.58 47.37 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 126.573 1.949 . . . . 0.0 107.698 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -75.76 104.02 6.12 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.539 -1.351 . . . . 0.0 108.978 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 2.6 t -99.3 115.84 30.09 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 150.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 p -128.06 1.1 5.89 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.87 1.268 . . . . 0.0 112.629 156.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 C--O 1.258 1.547 0 C-N-CA 131.239 3.815 . . . . 0.0 104.164 -167.54 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 13.0 pt . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -67.12 -177.27 0.99 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 121.719 1.613 . . . . 0.0 109.942 166.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.96 172.57 12.57 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 163.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -138.64 160.52 63.03 Favored Pre-proline 0 C--N 1.327 -0.378 0 C-N-CA 126.179 1.791 . . . . 0.0 107.661 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -76.23 95.14 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.003 2.469 . . . . 0.0 108.574 168.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -133.61 169.46 16.96 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 159.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.3 m -111.62 159.28 18.32 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.667 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 14.39 30.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.968 0.889 . . . . 0.0 112.553 -176.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.88 34.52 0.67 Allowed 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.476 1.11 . . . . 0.0 112.168 -168.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.05 152.46 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 126.954 2.101 . . . . 0.0 108.193 -172.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -140.81 157.02 68.54 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 126.869 2.067 . . . . 0.0 108.045 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -73.95 173.48 13.96 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.434 2.756 . . . . 0.0 110.991 -176.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.34 159.96 45.43 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 124.453 1.101 . . . . 0.0 110.644 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -76.3 176.12 10.47 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 123.543 2.828 . . . . 0.0 111.947 -175.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 55.02 54.32 9.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.76 1.224 . . . . 0.0 111.055 174.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 156.98 45.37 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 123.698 0.799 . . . . 0.0 111.627 -176.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.89 -38.0 31.77 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.898 3.065 . . . . 0.0 112.883 176.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.8 19.61 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.449 2.3 . . . . 0.0 115.468 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.84 -8.64 1.39 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.46 1.504 . . . . 0.0 113.261 -170.27 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.537 HG23 HD12 ' A' ' 23' ' ' LEU . 5.5 m -79.53 -19.37 49.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.971 1.26 . . . . 0.0 112.801 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -57.03 -19.23 17.57 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.124 1.329 . . . . 0.0 113.702 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 3.84 51.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.72 0.691 . . . . 0.0 110.388 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.537 HD12 HG23 ' A' ' 20' ' ' THR . 32.3 mt -84.99 66.19 9.63 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.492 1.042 . . . . 0.0 110.633 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -120.48 -48.35 2.3 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 124.125 0.97 . . . . 0.0 112.502 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -127.95 57.8 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.2 p -139.98 160.89 38.9 Favored 'General case' 0 C--N 1.337 0.055 0 CA-C-O 122.084 0.945 . . . . 0.0 110.63 -173.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.524 ' H ' ' NH1' ' A' ' 142' ' ' ARG . 3.2 p -142.49 136.43 29.38 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 124.123 0.969 . . . . 0.0 109.008 -158.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 47.8 m95 -149.97 165.22 33.31 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.855 0.722 . . . . 0.0 109.901 -165.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 70.4 t -142.01 123.53 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.52 130.84 45.21 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.55 -6.08 2.54 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.552 0.533 . . . . 0.0 111.918 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.9 162.13 36.87 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.019 -1.051 . . . . 0.0 110.918 169.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -145.76 116.69 7.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.63 138.72 38.24 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 174.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -71.28 167.27 19.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 118.574 0.625 . . . . 0.0 109.344 167.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.4 -30.16 70.38 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.18 0.592 . . . . 0.0 112.393 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -74.86 -45.07 45.49 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.69 3.47 1.78 Allowed Glycine 0 CA--C 1.531 1.035 0 CA-C-O 119.118 -0.823 . . . . 0.0 113.792 -172.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.6 m -65.04 101.63 0.53 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.377 2.089 . . . . 0.0 108.379 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.86 108.41 0.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.028 -1.045 . . . . 0.0 109.398 165.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -66.65 161.83 22.47 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.098 0.959 . . . . 0.0 110.446 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.38 145.34 39.48 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 158.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 m -140.49 165.42 30.22 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.424 1.89 . . . . 0.0 107.561 168.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.97 127.44 13.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 CA-C-N 120.556 1.234 . . . . 0.0 110.884 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.77 162.44 16.04 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.819 1.248 . . . . 0.0 112.002 164.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.15 -36.63 61.06 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.497 -0.752 . . . . 0.0 110.443 164.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.9 -21.06 60.21 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.936 0.895 . . . . 0.0 112.957 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -70.36 -11.86 61.2 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.574 -0.704 . . . . 0.0 112.523 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.1 -1.63 38.05 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 118.437 -1.202 . . . . 0.0 113.389 175.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB1' ' HE1' ' A' ' 68' ' ' PHE . . . -169.6 83.6 0.62 Allowed Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.844 1.258 . . . . 0.0 111.064 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.6 157.09 63.27 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 121.97 1.78 . . . . 0.0 110.357 171.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 32.2 mt -87.25 111.55 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.1 p -123.37 132.29 53.93 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -169.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.1 tp -111.58 134.5 53.11 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 124.993 1.317 . . . . 0.0 108.527 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.1 m -124.14 140.65 52.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 167.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.4 mt -123.3 121.56 36.15 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.9 t -172.67 -174.26 1.12 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.2 p -113.5 36.05 3.76 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.067 1.347 . . . . 0.0 112.545 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.8 m -49.12 -14.63 0.08 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 170.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -113.07 3.12 15.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.295 1.407 . . . . 0.0 111.096 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.02 -13.23 39.13 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 119.902 1.228 . . . . 0.0 111.692 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -113.67 166.07 11.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 121.232 -1.157 . . . . 0.0 110.422 164.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -55.47 115.78 2.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.642 1.177 . . . . 0.0 110.046 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.96 168.86 19.25 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.273 1.029 . . . . 0.0 108.403 176.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.13 73.47 1.45 Allowed 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.443 1.097 . . . . 0.0 109.12 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 t -68.98 116.42 9.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.73 175.84 25.03 Favored Glycine 0 C--N 1.328 0.087 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -167.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.584 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 29.6 t80 -129.56 106.87 9.04 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.3 m -78.05 -177.14 4.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.126 0.971 . . . . 0.0 108.796 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.98 -30.5 1.75 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 126.277 1.894 . . . . 0.0 117.324 -163.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.8 OUTLIER -147.58 6.88 0.84 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 119.403 1.601 . . . . 0.0 114.502 156.282 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -134.05 122.29 22.75 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -160.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -69.12 146.78 52.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.232 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -130.58 166.15 21.23 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 126.238 1.815 . . . . 0.0 109.422 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.1 ptp -154.7 163.21 40.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.448 1.899 . . . . 0.0 108.066 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 154.41 172.04 21.9 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 46.1 p -94.6 153.74 17.7 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.156 1.382 . . . . 0.0 111.589 -170.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -108.99 166.29 10.94 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.497 0.665 . . . . 0.0 110.764 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.11 122.2 7.7 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.112 1.365 . . . . 0.0 107.862 177.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.1 mt -101.47 111.84 24.2 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.565 1.546 . . . . 0.0 107.876 -172.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -154.52 163.53 40.06 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.171 1.788 . . . . 0.0 108.807 -175.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.7 29.24 2.11 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.694 2.398 . . . . 0.0 116.953 163.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.16 11.73 71.1 Favored Glycine 0 CA--C 1.533 1.196 0 O-C-N 120.85 -1.156 . . . . 0.0 113.228 -174.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -129.6 165.65 21.32 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.737 2.415 . . . . 0.0 112.242 -170.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.89 92.07 3.63 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.5 t -86.69 167.14 14.76 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -129.44 173.56 10.44 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.413 1.085 . . . . 0.0 110.702 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -106.34 -136.75 8.46 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 127.783 2.611 . . . . 0.0 108.942 170.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.9 m -64.42 83.65 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.771 1.629 . . . . 0.0 111.546 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.0 mt -77.02 143.33 39.43 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 120.848 -1.157 . . . . 0.0 108.929 169.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.83 -176.63 46.33 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.68 -141.66 3.27 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.518 0.659 . . . . 0.0 112.347 -159.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.7 t -115.53 168.22 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 169.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -126.71 90.8 3.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 171.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtm -102.68 172.85 6.61 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 168.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.78 107.12 8.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.542 1.519 . . . . 0.0 111.796 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.7 m -79.22 -7.18 58.05 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.183 0.993 . . . . 0.0 113.544 170.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 66.51 20.79 10.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.235 1.814 . . . . 0.0 113.227 176.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 p -127.03 161.31 54.58 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.099 1.76 . . . . 0.0 110.978 -170.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -37.4 5.68 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.37 2.047 . . . . 0.0 111.034 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.49 -30.5 75.11 Favored Glycine 0 C--O 1.22 -0.753 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.361 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -60.8 8.3 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.116 1.458 . . . . 0.0 109.889 167.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -81.82 1.86 32.82 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -164.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tt -78.99 -7.73 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.195 -0.941 . . . . 0.0 110.43 166.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.46 -59.28 2.5 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.689 1.596 . . . . 0.0 111.842 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.84 87.93 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 119.155 -0.803 . . . . 0.0 111.213 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.19 84.39 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 118.267 1.034 . . . . 0.0 109.985 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -64.38 -43.76 93.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.464 -0.779 . . . . 0.0 109.942 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.3 -38.02 76.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.885 1.221 . . . . 0.0 110.011 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -19.21 65.86 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.211 1.005 . . . . 0.0 113.631 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.6 -25.16 23.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.687 0.795 . . . . 0.0 110.681 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.78 11.62 3.77 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.908 1.283 . . . . 0.0 113.126 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.86 -5.99 15.36 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 125.667 1.587 . . . . 0.0 111.306 164.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -126.31 66.66 1.22 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.684 1.194 . . . . 0.0 108.415 -172.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 115' ' ' ILE . 3.1 mp -101.31 31.56 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 120.959 -1.088 . . . . 0.0 110.592 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -54.42 -29.06 48.0 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.232 -1.542 . . . . 0.0 113.435 -168.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -125.79 163.67 22.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.449 1.5 . . . . 0.0 110.02 170.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 93.6 m -157.97 165.81 34.18 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.355 1.462 . . . . 0.0 107.104 176.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -161.88 127.42 1.72 Allowed Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 169.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.74 142.35 16.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 118.874 1.337 . . . . 0.0 108.097 171.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.86 75.58 2.39 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 172.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.9 ttm -77.25 73.52 3.83 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.8 1.24 . . . . 0.0 107.757 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.5 140.22 12.37 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 171.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.2 132.19 95.01 Favored Pre-proline 0 N--CA 1.446 -0.674 0 N-CA-C 108.031 -1.099 . . . . 0.0 108.031 173.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -78.49 120.63 7.36 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 CA-C-N 119.925 1.009 . . . . 0.0 111.647 -1.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.67 131.18 45.11 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.56 0.695 . . . . 0.0 110.981 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -146.11 164.08 33.31 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.615 1.566 . . . . 0.0 106.948 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -138.48 147.96 43.8 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 125.842 1.657 . . . . 0.0 107.26 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -130.11 141.99 50.64 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 166.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.36 161.33 14.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 160.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.0 t -136.07 121.42 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.06 170.4 11.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.236 0.541 . . . . 0.0 111.158 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 46.1 p-10 -64.52 -26.11 68.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.481 169.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.58 -37.41 62.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 119.703 1.138 . . . . 0.0 108.848 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.53 10.92 9.94 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.373 -173.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -55.65 151.02 11.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 120.332 2.066 . . . . 0.0 108.628 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.6 m -130.41 96.67 4.2 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.802 0.841 . . . . 0.0 109.065 -175.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.04 133.07 36.82 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.623 1.169 . . . . 0.0 107.867 169.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.9 m -108.65 128.62 55.01 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.438 1.095 . . . . 0.0 109.431 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.87 131.07 54.19 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.725 1.21 . . . . 0.0 109.311 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.43 148.12 26.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.823 1.249 . . . . 0.0 109.62 172.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.524 ' NH1' ' H ' ' A' ' 27' ' ' SER . 34.0 tpt85 -70.26 132.94 46.48 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.737 -1.125 . . . . 0.0 108.423 173.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -133.87 60.91 1.69 Allowed 'General case' 0 C--N 1.347 0.47 0 CA-C-N 120.338 1.426 . . . . 0.0 110.517 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 3.77 7.92 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 ttm-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.195 1.398 . . . . 0.0 112.97 -169.804 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.74 175.48 4.42 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.469 2.112 . . . . 0.0 110.713 168.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' H ' ' CD2' ' A' ' 4' ' ' HIS . 54.7 mtmt -140.68 34.73 1.81 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.968 1.707 . . . . 0.0 108.844 173.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CD2' ' H ' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -171.7 161.11 4.87 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.269 1.828 . . . . 0.0 109.882 -162.678 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.39 -7.97 17.13 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.777 2.985 . . . . 0.0 112.697 169.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.54 21.34 11.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.242 2.217 . . . . 0.0 113.095 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.3 p -153.93 179.97 8.41 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.061 1.345 . . . . 0.0 109.897 174.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -130.59 82.64 2.07 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.557 1.543 . . . . 0.0 107.496 -175.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.85 90.71 3.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.609 1.564 . . . . 0.0 107.009 170.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -129.5 100.45 5.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.67 163.7 31.17 Favored Pre-proline 0 CA--C 1.535 0.385 0 C-N-CA 126.627 1.971 . . . . 0.0 108.411 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -68.4 137.45 39.76 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.025 1.817 . . . . 0.0 108.663 168.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -84.28 144.28 43.45 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.99 -166.78 0.43 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.17 2.58 . . . . 0.0 114.173 -166.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 63.27 77.53 0.32 Allowed 'General case' 0 C--N 1.342 0.281 0 C-N-CA 128.287 2.635 . . . . 0.0 110.896 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.82 144.45 89.94 Favored Pre-proline 0 N--CA 1.469 0.502 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.917 -177.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.53 -14.74 30.73 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 123.38 2.72 . . . . 0.0 112.528 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.64 31.9 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.405 1.882 . . . . 0.0 112.169 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -131.64 -28.3 1.84 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.741 -1.225 . . . . 0.0 112.213 -174.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.5 m -67.26 -17.23 64.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.994 0.815 . . . . 0.0 110.978 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -59.47 -11.26 4.22 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.961 1.304 . . . . 0.0 114.186 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.1 mt -106.6 7.72 30.85 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.526 1.53 . . . . 0.0 111.581 -172.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.37 51.8 0.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.121 1.368 . . . . 0.0 110.816 -172.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.45 0.95 0.81 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -165.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.0 -7.95 12.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.684 0.793 . . . . 0.0 111.451 148.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 80.8 p -73.83 -176.7 2.53 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.956 0.884 . . . . 0.0 112.047 -155.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -149.52 -68.42 0.21 Allowed 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.114 -2.241 . . . . 0.0 110.61 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.6 m95 69.78 163.44 0.24 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.822 1.249 . . . . 0.0 112.841 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.4 t -143.51 119.55 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.58 136.69 57.72 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.38 -11.51 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.95 151.37 28.44 Favored 'General case' 0 CA--C 1.515 -0.392 0 O-C-N 120.415 -1.428 . . . . 0.0 109.39 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -132.34 107.46 8.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -91.72 140.7 29.46 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -68.84 163.84 23.33 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.589 0.756 . . . . 0.0 110.372 166.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.52 69.82 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.708 0.803 . . . . 0.0 112.337 171.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -77.84 -21.22 51.8 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.502 0.592 . . . . 0.0 112.091 177.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.72 6.07 23.45 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.735 1.159 . . . . 0.0 114.669 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -68.28 115.41 7.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.877 2.071 . . . . 0.0 108.592 171.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.59 107.32 4.4 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.787 -1.196 . . . . 0.0 110.423 167.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.0 mtt180 -65.6 149.28 50.34 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.716 0.806 . . . . 0.0 110.18 173.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.97 139.59 58.78 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.104 0.562 . . . . 0.0 109.724 166.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -139.12 160.86 60.72 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 127.45 2.3 . . . . 0.0 108.574 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.78 116.06 4.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.532 2.155 . . . . 0.0 110.822 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.63 168.52 17.51 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.865 0.84 . . . . 0.0 111.597 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.26 -38.91 81.27 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.826 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -87.93 15.85 6.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.292 1.437 . . . . 0.0 111.597 176.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -105.76 -27.6 11.18 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.471 161.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.93 -27.33 3.67 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 123.545 0.593 . . . . 0.0 114.364 157.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -136.34 73.04 57.73 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 125.049 1.34 . . . . 0.0 110.101 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.11 143.54 78.56 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.858 1.705 . . . . 0.0 108.118 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 83.9 mt -70.83 99.56 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 125.526 1.53 . . . . 0.0 109.27 -169.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -87.41 149.85 24.19 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 126.544 1.938 . . . . 0.0 107.778 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 21.3 tp -127.87 157.8 39.52 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.299 1.44 . . . . 0.0 107.906 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.62 108.32 4.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.42 108.85 19.88 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 169.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 t -149.68 174.69 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.04 35.22 4.82 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.079 0.952 . . . . 0.0 109.924 171.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.2 t -48.35 -52.54 21.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.112 0.965 . . . . 0.0 110.224 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.5 t -84.52 10.23 11.48 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.656 1.182 . . . . 0.0 111.778 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.85 -38.63 2.82 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 127.016 2.246 . . . . 0.0 111.476 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -73.43 150.29 41.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 173.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -72.25 98.47 2.18 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 167.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.44 152.84 45.85 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 122.438 1.113 . . . . 0.0 110.375 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.93 133.37 41.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 153.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 53.5 p -116.24 172.0 7.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 141.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.93 175.1 39.27 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -109.64 94.62 5.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.6 m -73.56 80.21 1.47 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.697 0.761 . . . . 0.0 109.643 175.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.18 -51.57 4.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 124.388 0.994 . . . . 0.0 112.695 155.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -152.48 14.18 0.57 Allowed 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.924 -0.751 . . . . 0.0 111.873 153.56 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.7 110.32 6.71 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.775 -1.203 . . . . 0.0 108.304 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 136.06 40.45 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.957 1.703 . . . . 0.0 113.981 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -112.03 168.33 9.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 126.243 1.817 . . . . 0.0 110.788 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -152.73 156.72 39.69 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.142 1.777 . . . . 0.0 107.338 166.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -170.37 -109.29 0.22 Allowed Glycine 0 CA--C 1.525 0.711 0 O-C-N 121.622 -0.674 . . . . 0.0 111.883 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.6 168.88 22.69 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.405 1.482 . . . . 0.0 107.917 174.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -152.12 169.39 22.52 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.639 1.176 . . . . 0.0 110.661 170.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.18 157.15 42.3 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.77 1.628 . . . . 0.0 109.451 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.26 138.81 47.25 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.253 1.021 . . . . 0.0 108.834 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -162.31 164.69 27.36 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.922 2.089 . . . . 0.0 108.321 167.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.5 t0 51.67 32.83 9.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 162.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.34 29.43 63.21 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.197 -0.94 . . . . 0.0 113.332 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -128.54 154.79 45.78 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 128.173 2.589 . . . . 0.0 110.93 -175.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.4 HD22 ' CE1' ' A' ' 87' ' ' PHE . 0.1 OUTLIER -114.48 99.52 7.62 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 178.62 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -100.85 153.22 19.67 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 -175.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.472 ' CE1' HD12 ' A' ' 112' ' ' LEU . 37.9 m-85 -115.52 161.68 18.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.008 0.909 . . . . 0.0 110.087 -171.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.51 -168.09 37.9 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 108.693 -1.763 . . . . 0.0 108.693 159.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.85 149.97 34.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 165.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.8 mt -126.16 171.73 10.63 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.574 1.55 . . . . 0.0 110.568 -170.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.78 175.99 37.42 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 124.034 0.826 . . . . 0.0 111.081 164.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -159.43 -115.77 0.42 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.0 t -115.12 -175.1 2.62 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 129.793 3.237 . . . . 0.0 109.872 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.2 mmt180 -141.98 56.05 1.48 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.465 1.906 . . . . 0.0 108.337 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.97 159.01 31.53 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.265 -0.897 . . . . 0.0 109.753 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.9 112.18 23.84 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.989 1.316 . . . . 0.0 110.305 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.1 m -117.49 -9.34 10.86 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -176.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 55.7 mtm 61.03 22.37 12.63 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.148 0.979 . . . . 0.0 112.844 171.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.3 p -114.18 154.43 46.24 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 126.303 1.841 . . . . 0.0 108.988 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.57 -40.95 21.31 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 120.891 1.061 . . . . 0.0 109.522 170.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -70.54 -5.62 56.25 Favored Glycine 0 C--O 1.22 -0.742 0 CA-C-O 116.824 -2.098 . . . . 0.0 113.841 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . 0.401 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -78.25 -57.88 3.3 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 120.933 2.367 . . . . 0.0 109.784 168.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.36 -15.88 63.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.05 0.94 . . . . 0.0 111.846 -167.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.53 -6.13 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.716 0.806 . . . . 0.0 111.68 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -44.26 -52.57 7.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.706 1.139 . . . . 0.0 110.44 165.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -60.77 -46.36 94.65 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 119.934 -0.37 . . . . 0.0 112.498 -173.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.47 85.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.188 0.494 . . . . 0.0 109.81 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -68.64 -47.06 67.55 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.228 -0.92 . . . . 0.0 111.016 -173.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.01 -29.32 68.4 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.763 0.71 . . . . 0.0 111.017 173.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -42.02 90.91 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.084 0.554 . . . . 0.0 111.293 171.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.35 65.22 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.651 0.78 . . . . 0.0 112.111 -173.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 87' ' ' PHE . 1.1 mm? -71.83 -12.52 61.32 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.781 169.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 12.1 p -93.78 13.96 20.79 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.547 1.521 . . . . 0.0 112.311 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -141.11 28.72 1.87 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.53 1.059 . . . . 0.0 111.804 -171.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.9 mm -71.56 80.57 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 125.441 1.497 . . . . 0.0 107.447 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -80.27 -34.67 36.84 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 165.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -125.4 164.04 21.29 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.101 0.96 . . . . 0.0 110.576 -176.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 53.7 m -160.87 145.28 13.82 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.04 91.78 0.15 Allowed Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 108.229 -1.949 . . . . 0.0 108.229 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.483 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.266 4.5 p -87.59 132.46 32.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.389 1.094 . . . . 0.0 110.091 165.746 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -98.42 88.52 4.15 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 166.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 51.8 tpp -82.67 57.48 3.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 174.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -145.08 116.51 8.04 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.27 125.48 14.97 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-O 117.297 -1.335 . . . . 0.0 109.517 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 115.2 3.41 Favored 'Cis proline' 0 CA--C 1.538 0.691 0 O-C-N 122.933 0.965 . . . . 0.0 112.706 5.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -78.82 129.71 34.89 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -167.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.67 160.29 41.44 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.443 1.497 . . . . 0.0 108.424 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 46.6 ttp -134.09 127.11 31.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -123.61 109.72 14.11 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.813 0.845 . . . . 0.0 108.737 -174.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 16.3 mt -94.04 143.49 26.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -131.85 136.29 57.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.2 mp -95.33 171.27 8.81 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.625 0.726 . . . . 0.0 110.497 -174.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -53.31 -27.47 23.3 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 112.621 168.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -90.66 -16.56 28.38 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.193 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 105.99 8.35 34.25 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.693 -1.615 . . . . 0.0 115.607 177.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.18 165.45 0.09 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 120.063 1.931 . . . . 0.0 110.842 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.3 m -142.11 95.86 2.87 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 120.243 -1.536 . . . . 0.0 109.67 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.0 mp -86.92 146.72 26.06 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.156 -0.965 . . . . 0.0 108.68 173.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.4 m -125.46 125.23 43.0 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.94 1.296 . . . . 0.0 109.038 -176.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -123.07 135.01 54.23 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.322 1.049 . . . . 0.0 110.084 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -81.54 147.51 29.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.912 1.285 . . . . 0.0 108.338 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.8 tpt85 -76.26 100.42 5.08 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.694 -1.254 . . . . 0.0 108.94 165.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 20.7 t -75.76 127.65 33.48 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 146.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -131.47 17.2 4.88 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.455 1.902 . . . . 0.0 112.853 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 . . . . . 0 C--O 1.251 1.181 0 CA-C-N 118.872 0.76 . . . . 0.0 110.065 170.145 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.66 169.21 22.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.853 1.702 . . . . 0.0 109.552 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 106.77 17.24 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 170.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -101.53 165.48 13.98 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 125.704 1.602 . . . . 0.0 107.802 162.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.12 86.37 0.25 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.143 2.562 . . . . 0.0 110.019 170.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -141.23 175.03 9.97 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 130.347 3.459 . . . . 0.0 106.432 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.3 m -44.34 143.48 1.24 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 129.672 3.189 . . . . 0.0 111.932 172.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -87.89 14.43 8.85 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 172.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.29 75.07 9.89 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.3 m -133.88 154.86 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 126.68 1.992 . . . . 0.0 107.758 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.82 154.81 79.75 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.867 0.867 . . . . 0.0 109.307 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.22 165.98 26.76 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.821 2.347 . . . . 0.0 112.537 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.28 165.17 7.12 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.635 1.574 . . . . 0.0 110.205 170.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -76.64 -178.17 4.3 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 123.312 2.675 . . . . 0.0 113.034 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 75.29 86.52 0.09 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 128.415 2.686 . . . . 0.0 113.392 163.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.2 144.27 31.87 Favored Pre-proline 0 N--CA 1.472 0.66 0 C-N-CA 124.533 1.133 . . . . 0.0 111.158 -174.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -84.8 -18.51 4.47 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 124.215 3.277 . . . . 0.0 112.577 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.81 -10.36 8.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.992 0.917 . . . . 0.0 113.022 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -101.38 -2.37 31.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.409 2.284 . . . . 0.0 112.611 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.1 m -60.69 -57.21 13.67 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.098 1.317 . . . . 0.0 111.598 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.68 -18.14 0.65 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 178.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -80.78 5.25 16.42 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.125 1.37 . . . . 0.0 111.262 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.6 61.71 3.74 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 119.546 -1.971 . . . . 0.0 111.575 -173.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.24 -52.35 1.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 118.764 0.711 . . . . 0.0 112.646 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.0 -4.79 57.24 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.919 0.781 . . . . 0.0 111.79 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.5 -177.1 2.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.487 1.115 . . . . 0.0 111.499 -173.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.3 m -142.95 -57.73 0.43 Allowed 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.082 -1.636 . . . . 0.0 112.845 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 9.0 m95 69.83 165.68 0.27 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.342 1.857 . . . . 0.0 112.293 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -143.14 137.69 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -79.5 132.06 36.22 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 175.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.3 t -126.24 -17.05 5.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.38 158.35 34.08 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.653 1.115 . . . . 0.0 111.097 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -139.06 95.04 2.88 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.737 1.615 . . . . 0.0 108.672 -176.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.95 146.16 46.25 Favored 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 121.441 -0.787 . . . . 0.0 110.439 174.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 41' ' ' ARG . 28.3 mt-30 -80.23 166.49 21.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.096 1.358 . . . . 0.0 109.645 166.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.29 14.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.84 2.056 . . . . 0.0 113.497 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -137.13 4.61 2.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.154 1.782 . . . . 0.0 111.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.94 -5.0 78.93 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.357 -1.464 . . . . 0.0 112.961 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.3 m -68.94 108.41 3.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.659 1.584 . . . . 0.0 108.971 171.322 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.74 129.82 41.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.007 -1.058 . . . . 0.0 109.957 163.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 35' ' ' GLN . 28.3 mtt85 -77.86 172.69 13.08 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.827 1.651 . . . . 0.0 110.71 174.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.42 136.18 33.96 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 162.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.71 157.59 77.94 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.289 1.836 . . . . 0.0 108.486 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.86 123.9 9.72 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.753 1.635 . . . . 0.0 109.739 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -78.51 172.05 14.22 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 164.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -51.65 62.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.095 0.958 . . . . 0.0 111.911 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -67.31 -14.42 62.9 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -68.96 -15.75 63.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.749 1.159 . . . . 0.0 110.884 174.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.94 -30.76 3.65 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 123.343 0.497 . . . . 0.0 112.876 160.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.65 85.13 4.91 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -174.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -73.76 160.81 43.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.999 2.466 . . . . 0.0 112.708 -176.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.474 HG12 ' H ' ' A' ' 70' ' ' GLY . 16.5 mt -85.7 101.05 9.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.479 1.111 . . . . 0.0 108.772 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -121.54 119.16 31.14 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -79.31 164.94 23.68 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 175.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.2 m -149.82 111.71 4.57 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 119.918 -1.739 . . . . 0.0 108.34 167.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.13 147.22 29.17 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 164.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.6 t -165.4 158.22 15.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.8 p -130.88 29.36 4.74 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.567 -0.708 . . . . 0.0 110.089 167.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -53.76 -44.96 70.44 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.01 0.924 . . . . 0.0 112.018 -170.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -14.09 62.77 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.623 0.769 . . . . 0.0 112.623 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.2 2.26 55.81 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 125.497 1.522 . . . . 0.0 112.902 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.0 174.48 6.18 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.492 1.646 . . . . 0.0 108.967 164.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 26.8 mtp85 -82.21 63.07 6.23 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 125.871 1.668 . . . . 0.0 109.176 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.35 157.99 30.35 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 162.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.31 156.32 43.23 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 149.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 p -126.84 171.72 11.01 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 166.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.97 178.71 44.11 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.339 -1.504 . . . . 0.0 109.339 168.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -111.87 129.73 56.06 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 p -130.21 118.52 21.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.328 1.451 . . . . 0.0 109.3 -176.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.474 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 57.45 -78.83 0.01 OUTLIER Glycine 0 CA--C 1.526 0.778 0 C-N-CA 126.826 2.155 . . . . 0.0 112.052 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.0 OUTLIER -138.67 0.32 2.01 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 170.191 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -117.13 139.11 51.15 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 119.867 1.212 . . . . 0.0 109.587 175.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -70.75 154.93 41.39 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.57 -0.452 . . . . 0.0 109.889 161.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -138.15 164.96 27.85 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.399 1.479 . . . . 0.0 109.393 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -156.0 163.97 39.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.522 1.529 . . . . 0.0 108.469 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.56 -174.76 34.3 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 125.479 1.514 . . . . 0.0 109.331 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 p -84.14 159.57 21.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.587 0.694 . . . . 0.0 112.106 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 6.7 p90 -139.75 165.18 27.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 168.468 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.34 153.23 39.43 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.934 1.294 . . . . 0.0 110.78 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.6 mt -126.09 96.69 4.82 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 125.517 1.527 . . . . 0.0 109.62 -168.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -159.81 171.61 19.17 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -171.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 56.52 23.3 7.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.29 1.436 . . . . 0.0 113.948 171.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.46 25.18 68.39 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.048 -1.032 . . . . 0.0 111.54 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -144.87 161.63 38.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.428 1.114 . . . . 0.0 111.422 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.4 tp -78.86 157.19 28.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.8 p -148.96 159.07 44.54 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 120.553 -1.342 . . . . 0.0 108.509 164.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 95.8 m-85 -133.03 165.27 25.14 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.578 1.151 . . . . 0.0 109.211 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -102.72 -156.2 25.37 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 173.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.9 t -56.76 95.04 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.355 1.062 . . . . 0.0 110.234 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mt -84.1 156.56 22.1 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.312 2.245 . . . . 0.0 109.66 167.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -171.14 166.81 39.96 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 165.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -162.62 -174.78 32.94 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 108.305 -1.918 . . . . 0.0 108.305 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.08 173.89 7.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.644 0.735 . . . . 0.0 110.61 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -125.39 73.1 1.29 Allowed 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.276 1.431 . . . . 0.0 107.221 172.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 64.4 mtm -72.71 162.02 30.01 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.862 1.665 . . . . 0.0 109.01 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -106.55 133.43 51.25 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.286 1.034 . . . . 0.0 109.482 174.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 51.0 m -126.97 -9.35 6.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.107 0.963 . . . . 0.0 113.286 166.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.3 ptp 44.69 48.41 8.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.66 1.584 . . . . 0.0 113.123 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.3 p -135.68 156.45 77.49 Favored Pre-proline 0 C--O 1.239 0.537 0 C-N-CA 124.785 1.234 . . . . 0.0 110.372 177.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.95 -25.09 20.12 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.972 2.448 . . . . 0.0 111.85 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.95 -19.36 70.33 Favored Glycine 0 C--N 1.34 0.777 0 CA-C-O 118.439 -1.201 . . . . 0.0 111.561 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.46 -63.5 2.61 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-N 119.492 1.646 . . . . 0.0 110.326 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.42 -3.42 30.42 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -165.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.9 -18.14 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 O-C-N 121.725 -0.609 . . . . 0.0 111.673 167.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -46.53 -48.86 19.25 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.714 1.606 . . . . 0.0 111.302 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -54.34 -42.3 73.85 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.217 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.08 -37.12 61.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.989 0.895 . . . . 0.0 109.194 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.77 -44.83 96.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.192 0.597 . . . . 0.0 110.792 -174.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.72 -40.85 96.53 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.034 0.379 . . . . 0.0 109.983 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -17.66 64.66 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.58 0.752 . . . . 0.0 112.573 177.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.38 2.8 37.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.32 2.248 . . . . 0.0 112.281 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.0 mt -93.5 -26.89 16.97 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.116 1.325 . . . . 0.0 112.514 176.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.16 -11.04 42.3 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.794 1.179 . . . . 0.0 112.552 -178.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -96.98 106.51 18.86 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 168.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -136.02 65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 104.834 -2.284 . . . . 0.0 104.834 172.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.2 -33.76 73.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 116.276 -1.821 . . . . 0.0 109.93 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.722 ' HB2' ' CG1' ' A' ' 131' ' ' VAL . 74.5 mtt-85 -129.03 172.63 11.19 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-N 121.803 2.092 . . . . 0.0 112.981 162.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 m -150.44 150.93 31.99 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.822 1.649 . . . . 0.0 106.734 175.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -136.3 106.47 0.56 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 172.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -86.54 108.67 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 172.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 73.05 3.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 168.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttm -73.71 74.67 1.55 Allowed 'General case' 0 C--N 1.341 0.225 0 CA-C-O 122.717 1.246 . . . . 0.0 107.92 171.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -148.26 112.8 5.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 102.308 -3.219 . . . . 0.0 102.308 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.59 134.99 95.4 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-O 116.907 -1.521 . . . . 0.0 108.0 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -76.09 123.36 9.26 Favored 'Cis proline' 0 N--CA 1.451 -1.018 0 CA-C-N 120.847 1.338 . . . . 0.0 109.978 -2.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -61.72 149.57 39.32 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.297 1.046 . . . . 0.0 111.232 -173.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.54 163.69 31.34 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 126.487 1.915 . . . . 0.0 106.159 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.92 167.49 16.55 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 122.733 1.254 . . . . 0.0 109.098 173.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -148.45 135.4 20.06 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -130.59 153.77 48.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.722 ' CG1' ' HB2' ' A' ' 117' ' ' ARG . 2.6 p -138.45 158.43 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 119.854 -0.739 . . . . 0.0 111.812 175.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 136' ' ' ASP . 2.2 mp -103.64 158.22 16.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 122.5 1.143 . . . . 0.0 108.944 175.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -21.12 66.48 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 126.273 1.829 . . . . 0.0 110.841 -166.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -71.81 -35.62 70.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 128.351 2.66 . . . . 0.0 111.065 171.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 126.83 -2.97 7.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 126.485 1.993 . . . . 0.0 113.463 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.447 ' HB2' HD22 ' A' ' 132' ' ' LEU . 66.1 m-20 -68.01 110.46 3.93 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.193 -1.181 . . . . 0.0 108.363 -177.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 28.4 m -108.64 106.78 16.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.705 1.602 . . . . 0.0 109.483 -168.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.59 160.41 22.52 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.616 -1.303 . . . . 0.0 109.645 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 61.6 m -137.78 128.86 27.45 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.289 -1.507 . . . . 0.0 109.374 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -118.28 146.28 44.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.604 -175.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -88.19 151.85 22.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 166.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -66.77 135.41 53.93 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 159.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -136.49 113.97 10.92 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.756 -2.683 . . . . 0.0 103.756 158.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.9 p -126.21 12.95 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.321 1.448 . . . . 0.0 111.356 173.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 C-N-CA 123.851 0.86 . . . . 0.0 111.622 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 56.1 mt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -62.34 157.77 43.89 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 121.493 1.462 . . . . 0.0 110.342 173.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -165.28 155.82 13.71 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.136 2.174 . . . . 0.0 106.804 173.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -72.01 163.76 64.28 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 161.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -65.6 -22.46 58.14 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.722 1.614 . . . . 0.0 112.857 175.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -125.2 -4.95 7.32 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 129.754 3.222 . . . . 0.0 111.932 -168.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 m 66.23 -153.9 0.24 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.616 1.567 . . . . 0.0 111.273 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -141.25 12.09 2.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 122.448 1.118 . . . . 0.0 114.012 -171.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 43.83 63.97 1.42 Allowed 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.879 2.472 . . . . 0.0 114.861 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.8 t -117.63 131.57 69.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 122.045 0.926 . . . . 0.0 109.962 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.79 151.43 72.81 Favored Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.686 1.594 . . . . 0.0 110.507 175.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.13 142.63 61.93 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.312 2.008 . . . . 0.0 112.183 -167.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.02 162.12 76.09 Favored Pre-proline 0 C--O 1.239 0.546 0 C-N-CA 127.542 2.337 . . . . 0.0 109.267 -175.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.2 167.33 27.08 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.203 2.602 . . . . 0.0 111.062 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 63.79 64.17 0.79 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.906 1.683 . . . . 0.0 112.159 167.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -127.86 147.85 64.7 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 123.87 0.868 . . . . 0.0 112.423 -167.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.49 -26.41 34.33 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 124.132 3.221 . . . . 0.0 112.09 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.06 -18.7 3.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.95 1.7 . . . . 0.0 112.587 173.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -120.09 18.81 12.36 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.615 1.966 . . . . 0.0 111.016 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 84' ' ' LYS . 14.7 m -112.24 -14.2 13.38 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.307 0.958 . . . . 0.0 112.62 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -10.09 59.15 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 120.569 -1.332 . . . . 0.0 113.076 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.41 16.32 20.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.06 0.944 . . . . 0.0 109.214 -175.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.66 14.37 3.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.145 1.778 . . . . 0.0 113.75 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -76.0 -39.05 56.62 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 120.917 1.69 . . . . 0.0 112.033 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.63 -0.91 9.08 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -162.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.2 p -95.32 166.88 11.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.309 1.044 . . . . 0.0 111.642 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.7 m -144.96 149.2 34.8 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.787 1.635 . . . . 0.0 109.515 -169.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.439 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 69.1 m95 -157.93 172.88 17.66 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.781 1.232 . . . . 0.0 112.137 -150.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.8 p -157.02 119.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 177.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 138' ' ' LEU . 16.0 tp -60.71 127.86 33.75 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.53 -11.87 3.5 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 123.847 0.717 . . . . 0.0 111.527 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.52 151.28 32.43 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 119.607 1.094 . . . . 0.0 110.579 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -138.73 112.49 8.38 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.42 139.95 31.78 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 173.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -70.04 171.17 9.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 160.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.5 84.17 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.203 -0.311 . . . . 0.0 110.664 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 0.9 44.96 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.072 0.949 . . . . 0.0 111.601 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.67 -2.69 49.2 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-O 118.816 -0.991 . . . . 0.0 113.208 168.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 m -61.16 103.81 0.32 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.061 1.344 . . . . 0.0 108.818 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 119.01 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 120.779 -1.201 . . . . 0.0 109.684 169.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -73.24 155.43 39.55 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.092 0.957 . . . . 0.0 109.469 170.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.99 141.35 43.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.421 163.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -138.96 158.59 69.49 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 125.638 1.575 . . . . 0.0 108.24 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.4 109.0 1.92 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.07 1.846 . . . . 0.0 109.706 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.13 173.9 1.77 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.022 0.929 . . . . 0.0 110.5 174.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.11 12.08 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.263 -0.898 . . . . 0.0 110.37 170.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -71.61 -6.56 41.77 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -67.96 -13.45 62.18 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.867 1.212 . . . . 0.0 112.274 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 127.3 -72.66 0.46 Allowed Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.732 1.151 . . . . 0.0 112.131 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.69 85.21 21.24 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 126.101 1.761 . . . . 0.0 109.691 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.01 163.77 37.4 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.346 2.697 . . . . 0.0 112.754 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 16.3 mt -87.16 87.84 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.332 1.053 . . . . 0.0 108.741 177.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.27 130.14 54.18 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -174.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.2 tp -114.39 139.29 49.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.848 1.659 . . . . 0.0 106.942 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 m -125.81 137.73 53.79 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 168.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.5 128.47 56.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 167.573 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -169.74 177.29 4.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 40.8 p -93.27 47.74 1.28 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 109.647 164.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -61.63 -51.96 66.34 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.069 -1.02 . . . . 0.0 110.03 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.416 HG23 ' H ' ' A' ' 62' ' ' GLN . 8.7 t -71.38 -25.23 62.27 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.794 -0.566 . . . . 0.0 111.069 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.33 0.01 29.6 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.471 1.51 . . . . 0.0 113.848 -167.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.416 ' H ' HG23 ' A' ' 60' ' ' THR . 8.8 mt-30 -118.14 154.92 31.33 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.907 1.683 . . . . 0.0 108.415 166.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -76.99 78.0 3.54 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.677 1.191 . . . . 0.0 109.809 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -130.45 163.85 26.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.487 1.136 . . . . 0.0 113.939 -173.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.02 100.42 10.01 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 125.89 1.676 . . . . 0.0 106.823 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -108.33 63.69 0.61 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.592 1.187 . . . . 0.0 111.446 -177.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -110.21 169.14 13.37 Favored Glycine 0 N--CA 1.467 0.763 0 C-N-CA 125.146 1.355 . . . . 0.0 111.324 -163.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.529 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.6 t80 -95.03 129.9 41.92 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.6 t -108.16 175.09 5.6 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 163.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.84 -29.77 2.14 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 127.36 2.41 . . . . 0.0 116.639 -156.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.5 t -135.65 -27.03 1.19 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 118.757 1.278 . . . . 0.0 112.716 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.09 137.58 51.33 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.1 ptt180 -65.67 -174.74 0.23 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.82 -1.536 . . . . 0.0 110.43 170.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -149.91 168.48 23.66 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 124.103 0.961 . . . . 0.0 109.218 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -153.83 153.85 32.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 126.981 2.112 . . . . 0.0 105.965 167.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -164.59 -113.21 0.28 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.498 -1.841 . . . . 0.0 108.498 164.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.82 168.25 20.67 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 126.745 2.018 . . . . 0.0 106.951 157.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -118.43 -179.23 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.719 1.208 . . . . 0.0 108.848 165.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -164.41 116.88 1.32 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.332 0.969 . . . . 0.0 111.256 172.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.04 113.37 12.28 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.133 0.973 . . . . 0.0 109.203 -174.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -148.65 168.53 22.59 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.799 1.24 . . . . 0.0 108.116 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 t0 48.43 23.08 0.54 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.005 2.122 . . . . 0.0 116.064 172.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.442 ' O ' HG21 ' A' ' 118' ' ' THR . . . 67.53 20.49 71.87 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-O 117.136 -1.925 . . . . 0.0 111.976 -172.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.429 ' HA ' HG21 ' A' ' 20' ' ' THR . 0.4 OUTLIER -128.11 170.73 12.61 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 128.074 2.55 . . . . 0.0 111.572 -176.376 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.6 99.58 7.84 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -97.92 157.56 16.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -122.2 175.76 6.21 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.075 1.35 . . . . 0.0 110.379 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.25 -162.75 18.84 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 126.078 1.799 . . . . 0.0 109.483 172.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.2 t -59.01 115.13 2.94 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 163.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.03 155.78 18.39 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.889 1.275 . . . . 0.0 109.127 176.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.87 157.86 12.87 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 163.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.51 91.89 0.1 OUTLIER Glycine 0 CA--C 1.523 0.58 0 CA-C-N 119.187 1.493 . . . . 0.0 114.884 172.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 82.4 p 63.72 175.33 0.17 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 131.508 3.923 . . . . 0.0 112.004 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -137.86 53.4 1.84 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.921 1.689 . . . . 0.0 109.107 -176.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.2 mtm -61.62 170.74 1.79 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.184 0.994 . . . . 0.0 110.425 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.03 128.92 54.82 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.687 1.195 . . . . 0.0 110.414 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 74.3 m -134.28 101.47 5.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 126.446 1.898 . . . . 0.0 106.553 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 22.9 ptp -70.64 44.78 0.08 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.025 1.73 . . . . 0.0 113.22 -177.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.4 p -129.02 161.7 56.51 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 125.855 1.662 . . . . 0.0 107.801 -169.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.06 -47.53 6.36 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.165 1.91 . . . . 0.0 110.085 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.43 -1.76 66.13 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.775 -1.014 . . . . 0.0 112.361 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.95 -42.07 6.1 Favored Glycine 0 C--N 1.336 0.559 0 CA-C-N 118.849 1.324 . . . . 0.0 110.547 175.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.34 -16.34 40.3 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.213 1.006 . . . . 0.0 112.818 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.91 -15.34 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.771 0.829 . . . . 0.0 112.44 173.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -44.75 -47.51 10.78 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 125.604 1.561 . . . . 0.0 110.093 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -53.36 -47.61 61.87 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 119.579 -0.567 . . . . 0.0 111.785 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.97 74.43 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.682 0.741 . . . . 0.0 110.876 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.86 -42.71 90.06 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.7 -0.625 . . . . 0.0 110.216 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.24 -14.3 62.78 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.751 -1.218 . . . . 0.0 112.016 173.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.45 -8.32 45.01 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 169.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.92 -37.31 13.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.4 mt -72.93 -4.83 34.57 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.708 -1.245 . . . . 0.0 112.067 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 76.9 p -78.08 -8.47 58.26 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.674 1.189 . . . . 0.0 111.54 168.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -122.2 71.46 1.01 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.549 1.94 . . . . 0.0 107.633 -174.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.8 mm -107.95 66.2 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -73.8 -42.27 61.21 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 116.624 -2.03 . . . . 0.0 110.334 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -121.72 172.82 7.86 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.009 1.724 . . . . 0.0 110.578 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.442 HG21 ' O ' ' A' ' 83' ' ' GLY . 11.4 t -168.52 172.34 8.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -168.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 174.57 103.13 0.16 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 171.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 67.8 t -88.13 150.92 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 120.506 -1.585 . . . . 0.0 109.641 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.26 93.13 4.34 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.7 ttm -91.58 54.28 2.46 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 123.219 1.485 . . . . 0.0 110.052 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -135.55 126.11 26.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.245 -2.502 . . . . 0.0 104.245 170.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.82 128.6 93.81 Favored Pre-proline 0 N--CA 1.446 -0.659 0 CA-C-O 117.103 -1.427 . . . . 0.0 107.151 171.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.39 114.67 3.2 Favored 'Cis proline' 0 CA--C 1.539 0.749 0 O-C-N 123.531 1.279 . . . . 0.0 114.099 5.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.95 137.55 41.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.811 0.845 . . . . 0.0 110.778 -170.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -146.77 161.89 39.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.202 1.801 . . . . 0.0 108.0 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.33 148.66 27.78 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 171.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -129.42 133.58 47.41 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.311 0.577 . . . . 0.0 109.723 159.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.2 mt -117.65 148.5 41.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.775 1.23 . . . . 0.0 109.638 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.8 t -130.95 123.25 53.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -171.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 12.0 mt -71.64 166.93 20.87 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.64 -21.79 41.77 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.135 1.374 . . . . 0.0 111.259 173.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -80.97 -23.65 38.63 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 126.366 1.866 . . . . 0.0 111.72 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.74 -1.57 56.84 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 124.303 0.954 . . . . 0.0 113.448 -170.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.14 146.35 15.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.406 1.482 . . . . 0.0 108.623 170.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.4 m -135.56 102.84 5.24 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.63 1.172 . . . . 0.0 109.15 -163.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 30' ' ' LEU . 7.1 mp -93.5 128.05 39.44 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.402 -1.436 . . . . 0.0 109.167 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 32.2 m -107.68 131.92 53.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.533 1.133 . . . . 0.0 108.154 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -127.28 153.79 45.7 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.996 0.919 . . . . 0.0 110.625 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.587 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -86.36 156.31 20.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 117.489 -1.243 . . . . 0.0 108.553 -175.424 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -85.88 95.35 9.43 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.987 1.721 . . . . 0.0 107.453 162.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -92.0 76.33 5.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 6.4 t -82.24 13.2 3.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 115.736 -2.078 . . . . 0.0 110.897 -172.408 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.8 mp . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.62 -174.14 0.67 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.415 2.743 . . . . 0.0 110.959 168.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.33 167.48 20.96 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 161.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . 0.266 34.4 p80 54.68 164.36 0.05 OUTLIER Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 127.274 2.23 . . . . 0.0 111.801 -168.001 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -79.97 -45.83 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 0 CA-C-N 120.5 1.214 . . . . 0.0 111.308 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -161.8 -176.59 5.34 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 130.336 3.454 . . . . 0.0 105.837 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -54.79 133.86 47.6 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.704 1.602 . . . . 0.0 109.99 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -142.64 78.08 1.6 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 169.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -162.27 74.17 0.41 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.992 0.917 . . . . 0.0 110.071 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 t -138.22 86.92 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 121.084 -1.01 . . . . 0.0 108.851 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 60.58 165.11 0.1 OUTLIER Pre-proline 0 N--CA 1.471 0.59 0 C-N-CA 126.123 1.769 . . . . 0.0 112.531 -172.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.9 147.88 21.74 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 122.469 2.113 . . . . 0.0 108.874 168.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.39 156.67 62.53 Favored Pre-proline 0 C--O 1.24 0.555 0 C-N-CA 123.573 0.749 . . . . 0.0 109.856 174.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.12 168.21 23.93 Favored 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 123.171 2.581 . . . . 0.0 110.306 178.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 66.78 33.35 6.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.162 1.785 . . . . 0.0 112.525 172.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -84.92 144.36 41.67 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 118.231 0.469 . . . . 0.0 112.065 -173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.97 -23.28 30.03 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.761 2.308 . . . . 0.0 112.03 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.73 -1.73 1.46 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.405 1.882 . . . . 0.0 114.345 -179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.02 3.99 14.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.48 1.512 . . . . 0.0 112.004 -178.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.535 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.3 t -74.86 -12.24 60.33 Favored 'General case' 0 CA--C 1.556 1.183 0 O-C-N 121.447 -0.783 . . . . 0.0 111.119 -175.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -8.37 34.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 118.992 -2.318 . . . . 0.0 112.641 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.2 mt -105.9 21.08 17.9 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.337 1.055 . . . . 0.0 112.391 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.535 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.1 mm? -110.08 62.5 0.6 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.264 1.826 . . . . 0.0 109.169 -175.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 p-10 -137.29 -41.03 0.57 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 123.689 0.796 . . . . 0.0 112.129 -163.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -136.41 16.76 3.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.354 1.073 . . . . 0.0 110.897 -177.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.7 170.24 8.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.191 2.997 . . . . 0.0 109.114 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.3 m -152.18 148.27 27.41 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 119.295 -2.128 . . . . 0.0 110.096 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 28.0 m95 -148.78 175.3 11.35 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.067 1.347 . . . . 0.0 110.221 -162.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.9 t -146.29 127.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.82 133.1 47.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 t -133.56 -9.92 2.81 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.591 ' HB3' ' HB ' ' A' ' 139' ' ' THR . . . -154.41 140.78 18.69 Favored 'General case' 0 C--N 1.339 0.143 0 O-C-N 120.629 -1.295 . . . . 0.0 109.351 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -135.28 98.76 4.05 Favored 'General case' 0 C--N 1.334 -0.106 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.82 136.61 34.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 120.447 -1.408 . . . . 0.0 107.312 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -66.97 163.83 18.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 157.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.57 84.47 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.247 0.546 . . . . 0.0 111.033 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -12.63 59.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 122.776 0.43 . . . . 0.0 110.427 -175.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 119.46 -4.59 13.38 Favored Glycine 0 C--N 1.34 0.798 0 CA-C-O 118.317 -1.268 . . . . 0.0 114.276 169.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -73.22 107.75 5.72 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.894 1.847 . . . . 0.0 108.84 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.51 110.3 1.64 Allowed 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.631 0.772 . . . . 0.0 109.89 166.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -62.0 154.42 26.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.498 1.519 . . . . 0.0 110.308 172.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.66 132.61 47.82 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 m -138.87 156.35 72.73 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 124.402 1.081 . . . . 0.0 109.876 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.15 108.69 2.21 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.45 2.1 . . . . 0.0 110.249 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 168.78 12.96 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.091 0.956 . . . . 0.0 111.033 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.26 -7.95 46.33 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.369 1.468 . . . . 0.0 112.836 170.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -118.51 9.92 12.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.304 2.242 . . . . 0.0 111.078 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -98.63 -10.35 23.44 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.298 -0.876 . . . . 0.0 112.346 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.59 -45.0 1.19 Allowed Glycine 0 C--N 1.335 0.509 0 C-N-CA 123.847 0.736 . . . . 0.0 114.312 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.87 79.53 27.33 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 127.032 2.133 . . . . 0.0 109.8 -170.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -66.22 158.41 54.97 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 123.135 2.557 . . . . 0.0 111.231 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.1 mt -90.22 113.54 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 C-N-CA 124.341 1.056 . . . . 0.0 108.229 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.9 p -119.06 140.72 49.58 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 -171.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.1 tp -125.5 140.48 52.73 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.13 1.372 . . . . 0.0 108.791 -177.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 20.7 m -134.8 129.35 34.41 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.707 1.603 . . . . 0.0 107.208 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 56' ' ' LEU . 1.8 mm? -118.75 122.95 43.66 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 178.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -168.63 -153.12 0.12 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.8 p -122.46 46.86 2.04 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.266 1.026 . . . . 0.0 112.545 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.22 -46.85 88.33 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.571 -1.331 . . . . 0.0 111.851 -173.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -77.89 1.39 20.67 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.07 -1.644 . . . . 0.0 112.342 173.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.78 -9.86 74.66 Favored Glycine 0 CA--C 1.526 0.736 0 O-C-N 120.079 -1.638 . . . . 0.0 113.119 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -104.6 160.38 14.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 119.47 1.635 . . . . 0.0 108.962 164.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -64.33 91.27 0.07 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.839 0.856 . . . . 0.0 109.604 171.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -133.74 155.28 50.04 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.603 0.716 . . . . 0.0 110.021 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.79 146.78 26.62 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.62 151.95 45.81 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 154.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.45 177.92 48.06 Favored Glycine 0 N--CA 1.445 -0.763 0 O-C-N 121.222 -0.923 . . . . 0.0 112.227 -174.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -125.13 105.57 9.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.69 1.196 . . . . 0.0 107.994 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -85.03 -1.35 56.72 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 125.083 1.353 . . . . 0.0 113.915 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 149.48 -74.71 0.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 109.374 -1.49 . . . . 0.0 109.374 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 18.0 t -151.05 14.78 0.72 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 1.157 . . . . 0.0 113.386 177.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.08 -6.01 10.47 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.081 -1.637 . . . . 0.0 112.327 172.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 52.65 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.515 1.526 . . . . 0.0 111.441 -162.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -151.72 153.28 34.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.558 167.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -145.41 161.25 40.13 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.692 1.997 . . . . 0.0 107.19 170.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.46 163.43 11.6 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 171.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 20.3 m -69.59 163.91 24.45 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.935 0.894 . . . . 0.0 111.329 -170.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -137.93 171.94 13.68 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.53 0.732 . . . . 0.0 111.598 172.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.06 150.38 31.65 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.881 1.672 . . . . 0.0 108.024 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 70.1 mt -117.63 117.36 29.17 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -164.44 168.4 18.5 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.753 1.221 . . . . 0.0 109.285 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.0 t0 48.19 23.4 0.53 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.04 77.88 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 120.085 -1.634 . . . . 0.0 113.148 -175.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' A' ' 115' ' ' ILE . 25.1 pttt -141.37 140.9 33.8 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.065 1.933 . . . . 0.0 112.164 -174.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.552 ' O ' HG21 ' A' ' 115' ' ' ILE . 14.8 tp -82.88 105.15 13.65 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.852 1.661 . . . . 0.0 108.697 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.9 m -106.88 159.05 16.55 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.789 0.804 . . . . 0.0 109.534 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.486 ' HB3' HD21 ' A' ' 90' ' ' LEU . 73.3 m-85 -115.59 -165.92 1.08 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.69 1.196 . . . . 0.0 110.435 -167.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.37 -87.77 1.7 Allowed Glycine 0 C--N 1.334 0.433 0 O-C-N 120.717 -1.24 . . . . 0.0 110.085 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.8 m -154.69 69.22 0.74 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.696 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -61.92 164.2 6.76 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 120.923 -1.111 . . . . 0.0 112.494 -173.219 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -177.3 -179.98 47.83 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 169.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.13 -158.25 7.57 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.505 1.05 . . . . 0.0 111.642 -171.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 58.7 p -88.32 178.98 6.43 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 166.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -128.28 59.16 1.52 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.306 1.412 . . . . 0.0 110.724 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.9 mtm -59.19 165.06 2.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.493 161.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.93 153.33 24.66 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -134.71 159.64 40.65 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 123.629 0.771 . . . . 0.0 109.741 169.456 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -111.61 19.54 18.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 124.818 1.247 . . . . 0.0 110.772 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.4 p -96.49 165.09 16.8 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.125 1.77 . . . . 0.0 108.133 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.77 -42.06 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.261 1.974 . . . . 0.0 109.572 165.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.47 7.31 48.25 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-O 118.319 -1.267 . . . . 0.0 112.927 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.82 -55.84 2.08 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 108.136 -1.986 . . . . 0.0 108.136 170.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -60.47 -27.03 67.23 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.871 0.868 . . . . 0.0 112.487 -174.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -63.63 -17.91 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.581 0.752 . . . . 0.0 112.3 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.04 -40.91 64.27 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 119.364 0.984 . . . . 0.0 110.404 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.57 -28.18 72.07 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.088 -0.84 . . . . 0.0 111.973 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -80.42 -45.41 17.69 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.355 1.077 . . . . 0.0 110.031 171.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.14 -46.6 86.47 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 111.115 -171.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.54 -47.46 69.97 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 118.422 0.556 . . . . 0.0 109.549 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.57 -32.49 74.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.044 0.538 . . . . 0.0 111.735 -177.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.21 -26.49 68.15 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.303 0.641 . . . . 0.0 111.357 174.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 77.4 mt -69.02 -12.11 61.39 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.997 0.817 . . . . 0.0 112.25 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.3 p -91.3 -4.57 55.74 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.327 0.967 . . . . 0.0 111.806 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -117.82 71.52 0.82 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.552 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.9 mm -107.62 83.13 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 106.201 -1.778 . . . . 0.0 106.201 172.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -95.91 -28.87 14.48 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 119.365 -0.934 . . . . 0.0 112.257 166.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -130.16 166.54 20.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 122.493 1.14 . . . . 0.0 110.303 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.9 m -162.81 170.02 18.94 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 -177.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.44 143.04 10.18 Favored Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 105.319 -3.113 . . . . 0.0 105.319 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.6 t -129.47 128.52 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 174.047 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.01 88.82 2.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 -174.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 50.39 0.61 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.854 1.788 . . . . 0.0 111.659 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.24 128.39 48.22 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.219 2.607 . . . . 0.0 104.358 170.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.22 136.3 80.97 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-O 117.204 -1.379 . . . . 0.0 107.684 147.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -72.67 121.89 7.01 Favored 'Cis proline' 0 N--CA 1.456 -0.703 0 CA-C-N 120.341 1.157 . . . . 0.0 110.825 -8.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.68 138.9 41.63 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.622 0.725 . . . . 0.0 110.884 -171.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -146.27 153.76 40.94 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 171.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 44.8 ttp -116.36 145.31 43.31 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.491 1.516 . . . . 0.0 107.675 176.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -133.65 102.81 5.62 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.384 0.993 . . . . 0.0 110.868 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 73.3 mt -80.62 148.88 30.08 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 66.0 t -131.72 128.47 60.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 11.2 mt -81.49 156.49 25.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.75 -36.19 35.35 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.731 1.612 . . . . 0.0 112.454 177.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.75 -6.26 58.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.075 1.35 . . . . 0.0 111.27 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.96 -4.22 14.18 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.93 1.729 . . . . 0.0 114.897 157.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.28 156.83 7.02 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 109.845 -178.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 27.2 m -140.0 97.76 3.31 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.299 -0.876 . . . . 0.0 109.548 -172.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.36 142.58 30.93 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.591 ' HB ' ' HB3' ' A' ' 32' ' ' ALA . 35.7 m -127.85 129.6 47.2 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 125.82 1.648 . . . . 0.0 107.676 -173.27 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.42 121.66 27.8 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.619 1.168 . . . . 0.0 108.714 -167.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.93 144.24 41.18 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -70.57 129.43 39.18 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 172.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 47.8 t -136.13 83.94 2.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.52 19.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.202 1.401 . . . . 0.0 112.425 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 CA-C-O 114.56 -2.638 . . . . 0.0 110.441 -167.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.4 mm . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -97.12 77.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.995 2.463 . . . . 0.0 111.245 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.45 77.67 0.22 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.423 1.489 . . . . 0.0 111.019 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 65.36 165.85 0.12 Allowed Pre-proline 0 CA--C 1.548 0.893 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.796 -170.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.65 -4.98 15.11 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.679 2.253 . . . . 0.0 115.383 -166.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.82 69.44 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.449 2.3 . . . . 0.0 111.632 -166.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.2 m -63.78 14.08 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.355 2.662 . . . . 0.0 115.121 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -108.48 72.84 0.85 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.168 1.387 . . . . 0.0 108.203 -169.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 57.19 0.99 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.879 -1.055 . . . . 0.0 111.069 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.1 t -130.55 136.13 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 174.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.46 153.5 72.44 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 123.579 0.752 . . . . 0.0 110.697 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.99 176.94 8.38 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 124.162 3.242 . . . . 0.0 111.067 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.42 151.47 69.16 Favored Pre-proline 0 C--O 1.241 0.639 0 C-N-CA 123.36 0.664 . . . . 0.0 110.115 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.5 163.47 26.97 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.958 3.106 . . . . 0.0 111.624 174.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -143.48 46.49 1.5 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.508 2.723 . . . . 0.0 106.874 -175.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.9 t30 42.03 75.41 0.62 Allowed Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 127.748 2.419 . . . . 0.0 114.25 164.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -60.3 -17.72 48.44 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.178 2.585 . . . . 0.0 114.856 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.18 0.4 9.83 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.742 -1.224 . . . . 0.0 113.631 169.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.58 -26.19 54.8 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.998 1.719 . . . . 0.0 112.184 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.541 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.8 m -62.14 -30.03 70.76 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.324 1.42 . . . . 0.0 111.669 -160.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.0 pm0 -69.51 -20.14 63.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.039 0.936 . . . . 0.0 113.088 177.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.47 -7.58 59.6 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.248 1.019 . . . . 0.0 110.797 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.2 mm? -77.7 5.02 10.14 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.684 -0.635 . . . . 0.0 110.49 173.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -73.1 -20.68 60.9 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 127.433 2.293 . . . . 0.0 112.54 171.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.28 51.38 0.36 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -163.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -153.09 139.13 18.21 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.128 -1.608 . . . . 0.0 109.673 177.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 m -84.5 -64.48 1.15 Allowed 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 -166.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.408 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 15.8 m95 75.5 160.94 0.23 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.948 3.299 . . . . 0.0 115.369 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 53' ' ' THR . 6.0 p -150.19 115.54 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.033 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 138' ' ' LEU . 3.3 tm? -66.81 134.93 53.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.044 0.84 . . . . 0.0 109.456 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.519 ' N ' HD13 ' A' ' 30' ' ' LEU . 3.9 t -144.06 -2.23 0.92 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 174.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -155.12 150.86 27.6 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.462 -1.399 . . . . 0.0 111.455 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.673 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -139.2 132.12 29.36 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.758 2.023 . . . . 0.0 105.988 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.28 135.21 53.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.969 2.107 . . . . 0.0 107.36 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -78.13 170.2 17.01 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.221 0.534 . . . . 0.0 109.583 169.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.06 -15.71 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.07 3.82 44.58 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.756 1.223 . . . . 0.0 110.915 173.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.82 -7.72 81.22 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 124.559 1.076 . . . . 0.0 112.784 175.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 44.5 m -60.94 105.15 0.43 Allowed 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 126.969 2.108 . . . . 0.0 109.883 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.11 111.82 6.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.619 0.767 . . . . 0.0 109.658 170.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.07 155.02 39.77 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.656 0.783 . . . . 0.0 110.751 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.25 141.36 48.94 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 160.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.9 m -143.05 165.9 23.43 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 128.394 2.677 . . . . 0.0 105.63 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -64.42 124.66 13.68 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 CA-C-N 121.478 1.564 . . . . 0.0 108.516 168.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.77 153.86 42.38 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 123.843 0.857 . . . . 0.0 109.96 170.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.78 98.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.961 -0.462 . . . . 0.0 110.751 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.48 2.26 12.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.215 1.006 . . . . 0.0 112.052 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -84.67 -19.09 33.39 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.507 -0.759 . . . . 0.0 111.166 168.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 150.73 -84.14 0.16 Allowed Glycine 0 C--N 1.339 0.709 0 CA-C-N 119.589 1.086 . . . . 0.0 111.703 173.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -120.25 85.23 35.95 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 124.289 1.035 . . . . 0.0 109.945 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.12 175.46 3.19 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.684 2.922 . . . . 0.0 113.178 -178.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.488 HG12 ' H ' ' A' ' 70' ' ' GLY . 20.5 mt -85.08 76.82 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 124.928 1.291 . . . . 0.0 109.32 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.482 ' HA ' HG23 ' A' ' 29' ' ' VAL . 0.7 OUTLIER -87.11 127.68 35.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 104.174 -2.528 . . . . 0.0 104.174 -176.319 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.2 tp -86.59 156.91 19.85 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 172.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -142.3 122.69 13.99 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 168.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 mt -117.89 114.3 23.02 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -164.58 -169.06 1.65 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.038 1.735 . . . . 0.0 108.271 177.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.9 p -130.77 27.7 4.92 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.883 -1.136 . . . . 0.0 114.023 -164.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 t -55.67 -49.02 74.03 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.157 -0.965 . . . . 0.0 112.28 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.3 t -70.5 5.71 1.7 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.773 1.17 . . . . 0.0 112.612 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.52 -5.6 73.0 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 119.765 -1.835 . . . . 0.0 113.692 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -115.49 152.51 32.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 118.976 1.388 . . . . 0.0 111.583 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 ptp85 -70.88 74.35 0.61 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.906 1.682 . . . . 0.0 110.385 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -130.51 147.61 52.22 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.199 -0.938 . . . . 0.0 110.093 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.36 155.39 24.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -158.78 98.73 1.51 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 109.127 159.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -101.25 -158.76 27.16 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 15.4 t80 -126.02 122.41 35.8 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 104.558 -2.386 . . . . 0.0 104.558 174.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.466 ' CB ' ' CZ ' ' A' ' 108' ' ' TYR . 18.7 t -117.15 100.22 7.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.886 2.13 . . . . 0.0 111.315 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.488 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 76.59 -71.99 2.03 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 125.498 1.523 . . . . 0.0 111.855 172.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.8 t -135.62 -2.1 2.46 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.094 1.358 . . . . 0.0 111.353 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.49 108.74 7.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -62.16 159.57 14.48 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 122.466 1.127 . . . . 0.0 110.954 162.438 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -139.64 174.25 10.7 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 112.117 -2.311 . . . . 0.0 108.324 -168.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -159.96 165.6 31.71 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.927 0.891 . . . . 0.0 109.862 173.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 151.96 165.22 12.9 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 124.772 1.177 . . . . 0.0 110.794 164.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 60.6 p -74.12 168.02 20.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.737 0.769 . . . . 0.0 110.778 -163.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -135.51 176.47 8.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.822 0.849 . . . . 0.0 112.304 170.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.48 149.54 30.12 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.326 1.85 . . . . 0.0 107.726 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 23' ' ' LEU . 74.5 mt -128.42 78.67 1.86 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.775 1.23 . . . . 0.0 108.419 -163.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -147.1 168.16 22.29 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.445 1.098 . . . . 0.0 109.512 -169.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.5 t70 56.81 25.07 9.89 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.043 0.937 . . . . 0.0 112.513 169.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.32 -11.39 37.83 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.084 1.802 . . . . 0.0 113.662 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -121.21 137.25 54.76 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.841 2.321 . . . . 0.0 113.311 -163.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 38.4 tp -67.81 107.21 2.53 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 167.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.5 m -100.84 164.73 11.7 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.319 1.048 . . . . 0.0 109.211 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -137.21 147.72 46.02 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.703 0.801 . . . . 0.0 110.909 -175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.01 -154.31 27.27 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.269 1.89 . . . . 0.0 110.611 171.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.5 m -64.18 98.41 0.22 Allowed 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.3 0.64 . . . . 0.0 109.733 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -84.96 166.24 16.93 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 170.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 167.83 -171.81 42.4 Favored Glycine 0 CA--C 1.53 0.987 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.46 -150.9 8.22 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 118.93 1.365 . . . . 0.0 112.854 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.2 p -85.11 171.15 12.25 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.437 1.495 . . . . 0.0 112.051 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.6 mtt180 -130.04 62.03 1.57 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.572 1.149 . . . . 0.0 110.87 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 2.7 mtt -82.04 149.39 28.11 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.171 -0.955 . . . . 0.0 108.443 175.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -90.44 140.74 29.44 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.619 0.768 . . . . 0.0 110.855 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -117.55 -21.95 8.34 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 172.218 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 68.25 19.23 9.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.753 1.221 . . . . 0.0 112.213 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 81.2 p -120.59 155.5 56.73 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 126.44 1.896 . . . . 0.0 110.784 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.2 -28.57 47.99 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.543 2.162 . . . . 0.0 111.815 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.8 -8.41 87.77 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-O 117.994 -1.448 . . . . 0.0 113.126 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.63 -47.74 9.75 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-N 119.74 1.77 . . . . 0.0 109.315 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -70.21 -24.05 63.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.072 0.936 . . . . 0.0 113.367 -167.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.9 tt -64.49 -9.1 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 O-C-N 121.679 -0.638 . . . . 0.0 112.276 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.454 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 8.3 tm-20 -61.47 -16.09 43.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.366 2.266 . . . . 0.0 111.848 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -83.71 -29.05 33.34 Favored Glycine 0 CA--C 1.525 0.672 0 O-C-N 120.079 -1.638 . . . . 0.0 112.947 170.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.65 -47.09 20.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.713 1.256 . . . . 0.0 109.621 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.802 ' CZ ' HD13 ' A' ' 109' ' ' LEU . 0.3 OUTLIER -61.09 -37.45 82.79 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 122.965 0.506 . . . . 0.0 111.524 -162.149 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.802 HD13 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -69.96 -47.28 62.93 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.571 1.948 . . . . 0.0 109.386 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -14.15 56.22 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.402 1.081 . . . . 0.0 113.062 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -94.97 -28.97 14.88 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.057 1.343 . . . . 0.0 111.502 174.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.6 mt -71.59 -8.93 57.11 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.683 -1.261 . . . . 0.0 113.194 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 9.9 p -80.56 -9.94 59.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.17 0.895 . . . . 0.0 112.338 171.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -122.35 71.05 1.0 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 125.208 1.403 . . . . 0.0 109.759 -168.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.4 mm -103.61 54.16 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -28.42 69.89 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.803 -0.56 . . . . 0.0 111.048 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -141.14 166.23 25.34 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.665 1.586 . . . . 0.0 110.266 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.2 t -160.05 161.93 34.06 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.22 83.61 0.14 Allowed Glycine 0 CA--C 1.524 0.651 0 CA-C-O 119.799 -0.445 . . . . 0.0 113.286 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.5 p -91.14 97.19 6.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.684 1.742 . . . . 0.0 111.83 170.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.72 98.63 9.78 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.493 1.117 . . . . 0.0 108.512 171.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.0 mtt -86.32 30.57 0.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.411 1.484 . . . . 0.0 114.415 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.02 89.85 3.21 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 120.292 -1.505 . . . . 0.0 110.7 -166.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -36.53 120.56 0.76 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 126.441 1.897 . . . . 0.0 112.652 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.06 126.68 9.24 Favored 'Cis proline' 0 N--CA 1.459 -0.554 0 CA-C-N 119.908 1.003 . . . . 0.0 111.724 1.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -83.84 145.04 28.87 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -140.32 179.61 6.55 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 165.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -132.93 147.65 52.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 162.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -119.04 151.12 38.81 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 126.266 1.826 . . . . 0.0 108.0 170.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.5 mt -114.44 153.44 29.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 113.541 -1.663 . . . . 0.0 106.724 155.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 41.9 t -140.49 118.98 10.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 173.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 39.5 mt -76.18 173.65 11.07 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.288 1.042 . . . . 0.0 110.933 178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -57.56 -17.62 15.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.267 1.427 . . . . 0.0 113.355 158.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -78.5 -2.44 38.66 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.38 16.96 78.75 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 124.074 0.845 . . . . 0.0 112.457 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -173.24 0.44 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.831 0.852 . . . . 0.0 112.237 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 31.4 m -148.79 125.66 11.23 Favored 'General case' 0 N--CA 1.461 0.125 0 O-C-N 119.165 -2.21 . . . . 0.0 108.189 159.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.673 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -105.48 161.2 14.55 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.094 0.958 . . . . 0.0 108.485 170.572 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 30' ' ' LEU . 42.1 m -143.08 123.33 13.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.297 0.639 . . . . 0.0 110.515 -168.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.439 ' CZ ' HD23 ' A' ' 30' ' ' LEU . 66.6 m-85 -125.88 143.6 51.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.327 1.851 . . . . 0.0 110.981 -172.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -80.45 164.9 22.68 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 119.612 1.096 . . . . 0.0 108.813 175.707 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.448 ' HE ' HG21 ' A' ' 144' ' ' THR . 6.5 tpt180 -87.62 97.72 11.02 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 156.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.7 t -109.62 52.87 0.71 Allowed 'General case' 0 C--O 1.219 -0.516 0 O-C-N 120.955 -1.09 . . . . 0.0 108.552 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' THR . . . . . 0.448 HG21 ' HE ' ' A' ' 142' ' ' ARG . 1.4 t -76.88 8.02 4.18 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.372 -0.83 . . . . 0.0 111.987 176.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 124.062 0.945 . . . . 0.0 109.732 -173.824 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 22.9 mm . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -68.33 -179.89 2.55 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.496 2.13 . . . . 0.0 110.225 169.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -76.04 156.83 33.61 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 162.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -131.13 165.21 36.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 C-N-CA 126.843 2.057 . . . . 0.0 105.727 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.54 -22.76 28.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 121.27 1.314 . . . . 0.0 111.866 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.5 t0 56.81 162.57 0.02 OUTLIER 'General case' 0 C--O 1.234 0.259 0 C-N-CA 128.828 2.851 . . . . 0.0 112.125 -156.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.5 m -166.28 173.02 10.49 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.23 1.812 . . . . 0.0 108.695 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -74.39 18.31 0.16 Allowed 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.431 -0.793 . . . . 0.0 112.221 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.07 38.84 0.48 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.374 1.469 . . . . 0.0 112.572 -169.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -144.99 117.87 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.153 1.781 . . . . 0.0 106.884 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.52 157.99 75.78 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.65 168.71 19.24 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 122.781 2.321 . . . . 0.0 112.062 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.03 160.11 41.39 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.535 1.534 . . . . 0.0 111.978 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -74.65 -174.58 1.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 124.653 3.568 . . . . 0.0 111.516 -176.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 49.65 74.5 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.538 1.935 . . . . 0.0 113.263 167.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -131.16 144.78 54.92 Favored Pre-proline 0 N--CA 1.469 0.51 0 C-N-CA 123.841 0.856 . . . . 0.0 111.202 -166.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.15 -12.0 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.175 2.583 . . . . 0.0 112.257 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.95 -2.1 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.788 -1.195 . . . . 0.0 113.002 165.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.6 21.93 10.74 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.909 2.083 . . . . 0.0 110.818 172.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.4 m -84.8 -62.55 1.52 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.945 1.248 . . . . 0.0 113.949 169.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -26.09 67.65 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.081 1.764 . . . . 0.0 115.237 -160.27 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.73 -6.11 48.96 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.838 1.655 . . . . 0.0 111.168 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.14 17.31 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.689 1.196 . . . . 0.0 111.963 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.03 -11.25 44.71 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.007 1.723 . . . . 0.0 112.054 171.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -128.11 -12.04 5.23 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.418 HG22 ' NH2' ' A' ' 142' ' ' ARG . 75.0 p -82.62 170.25 15.36 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.593 -0.692 . . . . 0.0 111.839 -172.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -144.64 148.95 34.91 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -153.14 165.63 35.05 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 125.209 1.404 . . . . 0.0 108.98 -164.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 74.3 t -143.04 120.66 6.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.75 132.77 53.34 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -139.21 -14.12 1.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.078 0.769 . . . . 0.0 113.078 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.43 43.82 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.916 1.234 . . . . 0.0 109.337 166.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -142.06 93.96 2.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 133.96 45.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 171.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -65.02 164.41 12.85 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 156.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.1 65.57 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.937 0.495 . . . . 0.0 111.992 -172.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.21 -18.43 23.47 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.327 1.051 . . . . 0.0 112.529 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 127.37 -6.05 7.16 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 115.082 0.793 . . . . 0.0 115.082 176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -69.27 103.62 2.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 119.362 1.581 . . . . 0.0 108.72 176.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 122.75 18.39 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 121.196 -0.94 . . . . 0.0 108.977 170.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.8 mtt180 -75.89 153.3 36.82 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.597 1.559 . . . . 0.0 110.312 174.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.56 125.5 26.72 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 123.775 0.83 . . . . 0.0 109.97 168.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.0 m -131.29 155.31 81.68 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 126.139 1.776 . . . . 0.0 108.028 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.49 120.88 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.568 2.178 . . . . 0.0 110.802 -178.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 168.03 8.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.346 -0.846 . . . . 0.0 111.913 164.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.28 -32.04 64.19 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 121.346 -0.846 . . . . 0.0 111.757 167.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.39 -13.3 52.61 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 121.63 -0.669 . . . . 0.0 112.517 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -75.49 -17.7 60.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.95 -22.72 5.68 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 123.735 0.683 . . . . 0.0 114.131 163.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.64 85.47 3.68 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.397 1.099 . . . . 0.0 111.087 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.84 154.26 71.38 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.93 1.753 . . . . 0.0 111.578 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.6 mt -87.48 103.22 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 127.382 2.273 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 p -123.88 135.68 53.87 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.336 -164.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -128.88 135.52 49.18 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.452 1.901 . . . . 0.0 109.432 -167.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.0 m -146.35 115.27 6.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -104.51 112.21 25.18 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.6 t -161.02 -174.5 4.41 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.3 p -93.75 35.42 1.14 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.969 0.908 . . . . 0.0 112.178 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.7 t -50.49 -55.27 16.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.856 1.207 . . . . 0.0 114.191 -161.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -94.0 8.8 40.06 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.572 1.078 . . . . 0.0 110.669 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.48 -24.51 5.25 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.199 1.381 . . . . 0.0 114.615 165.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.4 166.37 14.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 128.111 2.565 . . . . 0.0 109.288 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 3.9 ptp85 -66.94 97.01 0.46 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.71 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.5 170.86 15.0 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 123.839 1.78 . . . . 0.0 113.002 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.91 75.18 0.94 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 112.036 -2.347 . . . . 0.0 107.131 -175.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.91 86.61 4.79 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -128.68 179.49 16.58 Favored Glycine 0 CA--C 1.507 -0.415 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 -165.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -118.51 140.03 50.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.855 0.836 . . . . 0.0 109.061 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -144.99 135.1 23.93 Favored 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 128.49 2.716 . . . . 0.0 104.757 -171.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 44.14 -91.83 0.01 OUTLIER Glycine 0 CA--C 1.524 0.608 0 C-N-CA 127.514 2.483 . . . . 0.0 112.465 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.4 t -152.63 33.1 0.5 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.721 1.248 . . . . 0.0 111.572 162.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -125.03 -7.17 7.19 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 120.547 -1.346 . . . . 0.0 114.012 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 44.89 177.52 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 129.114 2.966 . . . . 0.0 113.106 -175.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -154.95 159.21 40.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.117 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.21 160.0 23.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.746 1.618 . . . . 0.0 108.61 173.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 170.82 -86.06 0.08 OUTLIER Glycine 0 CA--C 1.527 0.822 0 CA-C-O 119.479 -0.623 . . . . 0.0 112.274 163.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 p -164.56 162.21 21.56 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.585 1.954 . . . . 0.0 110.099 -178.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 37.7 p90 -143.99 171.71 13.87 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.099 0.96 . . . . 0.0 110.876 165.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -149.48 142.15 24.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 126.161 1.784 . . . . 0.0 108.617 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -102.09 93.36 5.2 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 122.179 0.99 . . . . 0.0 109.762 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -124.16 176.75 6.2 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.653 1.981 . . . . 0.0 108.695 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 52.81 14.11 0.4 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.41 2.284 . . . . 0.0 116.078 174.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 56.38 35.77 67.18 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 120.082 -1.636 . . . . 0.0 111.856 -163.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -142.66 177.31 8.39 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 127.015 2.126 . . . . 0.0 112.353 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -87.13 139.9 30.1 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.1 p -131.91 148.38 52.53 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.448 1.476 . . . . 0.0 109.948 161.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.435 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.4 m-85 -112.88 157.66 21.15 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.286 1.034 . . . . 0.0 109.79 178.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.95 -153.43 25.72 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.646 1.117 . . . . 0.0 112.047 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.37 86.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.442 1.897 . . . . 0.0 108.694 170.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.468 HD13 HD23 ' A' ' 112' ' ' LEU . 67.2 mt -79.52 173.44 12.58 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 120.995 -1.066 . . . . 0.0 111.605 -175.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 159.01 179.42 33.84 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 170.524 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.09 -109.77 0.43 Allowed Glycine 0 C--N 1.333 0.384 0 C-N-CA 125.166 1.365 . . . . 0.0 111.01 -171.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -155.61 159.49 39.67 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.796 1.638 . . . . 0.0 107.958 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -103.14 38.37 1.77 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.591 1.556 . . . . 0.0 110.371 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mtm -59.85 162.54 5.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.164 0.986 . . . . 0.0 109.549 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -107.17 144.14 34.35 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -125.49 -15.85 6.0 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 176.568 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.259 18.1 ptp 46.39 44.57 12.94 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.186 1.794 . . . . 0.0 112.419 -174.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 80.0 p -132.55 157.43 78.34 Favored Pre-proline 0 C--O 1.239 0.527 0 C-N-CA 125.417 1.487 . . . . 0.0 109.58 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.79 -27.69 21.25 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 121.533 1.488 . . . . 0.0 112.045 173.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.472 ' O ' HG22 ' A' ' 104' ' ' ILE . . . -63.9 -36.1 92.85 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 169.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.08 -35.28 91.23 Favored Glycine 0 C--N 1.335 0.519 0 CA-C-N 120.096 1.948 . . . . 0.0 113.304 -170.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -86.12 -13.56 46.81 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.036 0.918 . . . . 0.0 112.85 -175.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 101' ' ' GLY . 9.7 tt -68.31 -9.9 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 118.918 0.781 . . . . 0.0 111.22 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -44.74 -51.3 9.46 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.824 0.85 . . . . 0.0 110.899 166.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.7 -39.01 92.99 Favored Glycine 0 C--N 1.337 0.639 0 CA-C-O 119.089 -0.84 . . . . 0.0 111.381 -173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.41 -45.83 65.16 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.475 0.71 . . . . 0.0 110.256 175.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -63.64 -45.12 91.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.781 0.832 . . . . 0.0 110.91 -171.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.0 mt -62.72 -36.37 82.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.197 0.908 . . . . 0.0 109.827 173.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -17.78 64.76 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.079 1.352 . . . . 0.0 113.143 175.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.03 -33.06 12.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.776 1.23 . . . . 0.0 110.658 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.468 HD23 HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -63.85 -21.44 66.44 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.546 1.538 . . . . 0.0 112.084 176.095 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -81.64 -9.42 59.67 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.478 1.511 . . . . 0.0 112.842 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -133.46 65.66 1.58 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -175.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.0 mm -89.15 69.98 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 103.413 -2.81 . . . . 0.0 103.413 163.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -73.27 -44.94 58.4 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 118.785 -1.166 . . . . 0.0 109.044 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -122.07 168.19 12.25 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.222 1.809 . . . . 0.0 109.767 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.2 t -163.67 170.9 16.41 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.853 -1.154 . . . . 0.0 108.482 -167.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -177.65 104.25 0.19 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.232 -1.147 . . . . 0.0 110.232 175.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.3 p -113.13 142.87 24.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 O-C-N 121.144 -1.209 . . . . 0.0 109.598 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -120.75 78.91 1.43 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 125.888 1.675 . . . . 0.0 106.745 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 48.1 ttm -76.09 62.85 1.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.381 171.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -147.23 104.97 3.71 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -45.37 125.51 5.91 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.988 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.66 124.0 8.77 Favored 'Cis proline' 0 N--CA 1.459 -0.553 0 CA-C-N 119.95 1.018 . . . . 0.0 111.629 3.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -79.0 134.6 36.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -141.43 162.39 35.59 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 163.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -127.06 147.52 50.15 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 126.133 1.773 . . . . 0.0 106.247 172.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -146.18 128.06 15.41 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -171.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -114.3 151.36 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.47 -0.769 . . . . 0.0 109.122 -178.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.42 117.6 47.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.3 mp -68.73 169.21 11.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.783 0.801 . . . . 0.0 110.865 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -53.57 -33.26 54.13 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.584 1.554 . . . . 0.0 112.058 172.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -84.19 -27.38 28.07 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.478 -0.764 . . . . 0.0 112.148 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.37 -5.17 10.17 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 117.856 -1.524 . . . . 0.0 115.179 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -52.33 127.46 22.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.56 1.68 . . . . 0.0 108.771 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.2 m -105.5 98.14 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.918 1.287 . . . . 0.0 109.17 -170.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.3 mp -83.21 142.62 31.03 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.496 -1.377 . . . . 0.0 108.608 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 54.4 m -123.73 132.04 53.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.492 1.117 . . . . 0.0 109.888 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -128.76 133.6 48.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.586 1.554 . . . . 0.0 109.384 -175.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.62 158.87 20.74 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.418 ' NH2' HG22 ' A' ' 26' ' ' THR . 10.9 tpt180 -84.16 133.97 34.59 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -117.23 65.92 0.73 Allowed 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 7.3 t -74.81 -1.04 20.35 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 124.464 1.105 . . . . 0.0 111.569 -167.913 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 33.8 mm . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -62.78 173.03 4.03 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 N-CA-C 108.417 -1.417 . . . . 0.0 108.417 152.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -112.63 166.01 11.73 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 165.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -62.51 161.51 26.29 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 123.52 0.512 . . . . 0.0 110.409 167.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.75 -5.97 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.464 2.776 . . . . 0.0 112.784 170.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -141.87 -159.43 0.97 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 128.086 2.554 . . . . 0.0 105.707 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -64.55 162.47 15.4 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.7 1.136 . . . . 0.0 111.142 177.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -108.66 14.88 24.15 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.524 1.53 . . . . 0.0 111.156 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.82 70.43 6.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.035 1.734 . . . . 0.0 111.019 -171.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -102.95 114.68 43.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 C-N-CA 126.41 1.884 . . . . 0.0 106.902 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.95 151.14 93.95 Favored Pre-proline 0 CA--C 1.541 0.6 0 C-N-CA 122.745 0.418 . . . . 0.0 110.239 176.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -80.28 179.44 6.15 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 123.449 2.766 . . . . 0.0 112.237 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.86 145.86 40.15 Favored Pre-proline 0 C--O 1.242 0.69 0 C-N-CA 125.874 1.67 . . . . 0.0 112.458 -172.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -74.92 179.41 6.09 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.74 2.96 . . . . 0.0 111.654 174.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 57.96 170.66 0.05 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.014 1.725 . . . . 0.0 110.309 -165.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -166.11 148.25 6.14 Favored Pre-proline 0 C--O 1.238 0.454 0 O-C-N 121.161 -0.962 . . . . 0.0 108.581 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -63.26 -26.61 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.753 2.302 . . . . 0.0 111.276 173.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.13 4.11 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.529 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -99.52 -13.99 19.24 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 120.138 1.335 . . . . 0.0 111.126 165.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.46 -20.11 34.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.696 1.134 . . . . 0.0 112.883 -172.016 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -8.5 33.33 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 120.577 -1.327 . . . . 0.0 113.572 176.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.79 13.78 29.29 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.374 1.07 . . . . 0.0 109.867 -177.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.81 31.25 0.36 Allowed 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.007 -1.058 . . . . 0.0 110.543 177.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -85.04 -54.53 4.58 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.403 0.681 . . . . 0.0 110.044 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -118.39 2.65 11.88 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.8 1.64 . . . . 0.0 113.398 -173.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.8 p -78.97 156.33 28.53 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 123.229 1.49 . . . . 0.0 111.344 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.66 154.54 51.48 Favored 'General case' 0 N--CA 1.441 -0.925 0 O-C-N 120.332 -1.48 . . . . 0.0 109.063 -177.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.499 ' HD1' HD12 ' A' ' 54' ' ' LEU . 32.3 m95 -152.9 162.18 41.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -164.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.9 t -144.66 132.82 17.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 138' ' ' LEU . 12.0 tp -81.15 150.95 28.49 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -173.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.6 t -139.22 -23.4 0.9 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.62 161.15 43.13 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.227 -1.546 . . . . 0.0 110.224 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.615 ' CG ' HD21 ' A' ' 138' ' ' LEU . 1.3 t90 -140.31 139.28 35.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.772 1.629 . . . . 0.0 107.315 169.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.99 135.99 54.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.739 1.616 . . . . 0.0 109.683 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -69.19 160.89 30.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 109.191 163.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.01 73.64 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 111.977 172.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.89 -4.13 42.2 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.612 -0.68 . . . . 0.0 111.72 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.85 -3.05 62.37 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-O 118.26 -1.3 . . . . 0.0 112.178 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.6 m -60.67 103.95 0.3 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.053 1.427 . . . . 0.0 107.742 170.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.5 132.9 55.39 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 165.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.91 147.58 26.19 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 169.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.26 144.25 54.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 161.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -141.67 152.34 62.67 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 126.129 1.772 . . . . 0.0 106.776 170.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.08 117.29 4.62 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 121.192 1.261 . . . . 0.0 108.894 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -76.22 174.36 10.22 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.37 72.21 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.189 -0.944 . . . . 0.0 111.215 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -77.66 -7.23 56.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -79.24 -9.0 59.47 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.341 -0.849 . . . . 0.0 111.937 168.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.27 -23.7 17.8 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 118.741 -1.033 . . . . 0.0 113.179 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.02 76.7 21.73 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.632 1.173 . . . . 0.0 110.426 -168.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.87 128.21 21.43 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 122.331 2.021 . . . . 0.0 110.27 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.5 mm -60.28 96.52 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.202 1.801 . . . . 0.0 109.805 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.9 p -108.55 122.34 46.86 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.35 1.06 . . . . 0.0 108.858 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.499 HD12 ' HD1' ' A' ' 28' ' ' TRP . 1.9 tm? -109.28 140.5 42.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.72 1.608 . . . . 0.0 107.877 -177.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 m -139.61 122.78 16.91 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -92.7 136.49 33.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 156.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.7 t 174.55 -154.82 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.718 2.807 . . . . 0.0 106.044 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.3 p -123.84 42.49 3.22 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.94 1.296 . . . . 0.0 111.913 -172.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.86 -6.75 2.95 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 119.546 -1.971 . . . . 0.0 114.729 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 70.8 p -122.94 -1.41 8.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.583 1.553 . . . . 0.0 112.06 166.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.55 -7.18 74.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.372 1.463 . . . . 0.0 113.24 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -89.68 170.33 10.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.005 1.903 . . . . 0.0 109.143 170.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -69.75 86.23 0.49 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 160.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.5 141.33 47.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.849 1.66 . . . . 0.0 107.388 -171.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.7 151.37 23.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.23 132.03 22.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 162.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.76 164.92 33.87 Favored Glycine 0 C--N 1.33 0.195 0 O-C-N 121.141 -0.974 . . . . 0.0 110.924 -178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -95.5 120.52 35.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -83.12 -158.67 0.29 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.591 1.156 . . . . 0.0 108.378 166.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLY . . . . . 0.419 ' HA3' ' O ' ' A' ' 101' ' ' GLY . . . -72.36 -17.86 77.88 Favored Glycine 0 CA--C 1.526 0.748 0 O-C-N 121.082 -1.011 . . . . 0.0 114.597 -170.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 44.0 t -150.88 -41.32 0.12 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.221 0.609 . . . . 0.0 109.666 162.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -103.47 105.7 16.03 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-O 122.17 0.986 . . . . 0.0 108.855 -170.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -60.11 148.95 34.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.298 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -139.43 174.14 10.82 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 124.595 1.158 . . . . 0.0 109.104 -163.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -155.54 166.09 34.6 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.456 1.903 . . . . 0.0 108.736 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.62 166.05 20.72 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.52 1.057 . . . . 0.0 110.537 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 p -72.33 166.1 23.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 118.383 1.092 . . . . 0.0 111.306 -177.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -142.01 175.27 9.87 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.621 0.768 . . . . 0.0 110.955 171.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.78 12.31 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.518 1.927 . . . . 0.0 109.737 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.27 99.33 12.37 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.216 1.807 . . . . 0.0 106.399 168.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.26 165.14 32.79 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.563 1.145 . . . . 0.0 108.413 173.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 37.3 t70 60.34 6.24 1.0 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.595 1.958 . . . . 0.0 114.92 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.2 27.91 69.88 Favored Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.119 -1.613 . . . . 0.0 111.696 -163.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.418 ' HB2' ' CG2' ' A' ' 118' ' ' THR . 25.6 pttt -121.28 171.02 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.119 1.368 . . . . 0.0 109.089 166.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.3 tp -98.92 134.92 41.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 164.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.86 134.78 48.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 119.589 1.086 . . . . 0.0 108.538 166.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -90.41 -176.2 4.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.374 0.67 . . . . 0.0 110.362 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -120.92 -149.29 8.16 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 126.292 1.901 . . . . 0.0 109.508 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.9 t -69.66 85.98 0.47 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.5 mt -77.35 135.77 38.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.674 1.59 . . . . 0.0 109.363 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -169.32 168.88 41.59 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-O 121.638 0.577 . . . . 0.0 112.553 171.306 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.37 -168.83 13.25 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 125.1 1.333 . . . . 0.0 109.976 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.2 p -73.89 -179.05 3.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.54 1.136 . . . . 0.0 110.67 171.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -129.49 82.28 2.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.3 mtt -77.02 -175.87 3.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 167.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.84 110.69 16.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.081 0.953 . . . . 0.0 110.85 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 64.9 m -120.07 102.93 8.87 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 124.063 0.945 . . . . 0.0 108.552 164.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.45 57.16 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.643 2.777 . . . . 0.0 113.216 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -149.32 155.29 39.51 Favored Pre-proline 0 C--O 1.239 0.51 0 O-C-N 120.935 -1.103 . . . . 0.0 110.129 -161.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.62 -29.57 12.93 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.573 2.182 . . . . 0.0 111.126 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.419 ' O ' ' HA3' ' A' ' 70' ' ' GLY . . . -76.11 -8.19 84.96 Favored Glycine 0 C--O 1.217 -0.945 0 CA-C-O 117.5 -1.722 . . . . 0.0 111.471 172.009 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.38 -59.12 2.07 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 120.769 2.284 . . . . 0.0 110.698 175.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.83 -12.26 60.25 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -165.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -65.15 -16.9 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 125.837 1.655 . . . . 0.0 113.335 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -45.38 -50.44 12.28 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.871 1.268 . . . . 0.0 111.319 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -56.52 -37.79 77.14 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-N 118.87 0.759 . . . . 0.0 112.179 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.25 63.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.256 1.028 . . . . 0.0 110.161 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -55.12 -48.09 74.1 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 15.0 mt -65.31 -38.73 91.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.938 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.08 -19.7 64.88 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -92.54 -43.95 8.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.734 1.214 . . . . 0.0 111.041 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.37 -18.14 60.78 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -175.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -72.63 -11.32 60.59 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.179 0.991 . . . . 0.0 113.066 174.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -124.45 56.39 1.28 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 120.333 1.424 . . . . 0.0 110.859 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.1 65.81 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.76 -31.61 59.61 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.193 -0.942 . . . . 0.0 109.997 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -124.19 162.81 22.86 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.004 1.321 . . . . 0.0 108.924 170.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' A' ' 84' ' ' LYS . 7.9 p -132.42 -163.7 1.37 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.081 0.952 . . . . 0.0 111.232 -162.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.8 83.5 0.04 OUTLIER Glycine 0 C--O 1.225 -0.463 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.998 156.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.2 p -97.86 151.0 4.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 119.109 1.454 . . . . 0.0 109.366 166.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.46 122.35 26.07 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 128.574 2.75 . . . . 0.0 104.474 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 4.0 ttm -114.01 42.55 2.02 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.752 2.021 . . . . 0.0 110.404 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -134.32 87.66 2.38 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.074 1.75 . . . . 0.0 107.973 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -47.72 133.79 10.93 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 125.897 1.679 . . . . 0.0 112.782 -162.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.66 122.61 7.92 Favored 'Cis proline' 0 C--N 1.346 0.441 0 CA-C-O 121.988 0.745 . . . . 0.0 113.083 4.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -82.06 126.77 32.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.346 1.058 . . . . 0.0 108.454 -174.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -141.73 149.16 40.14 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 55.5 ttp -126.98 141.57 51.76 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -170.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -112.82 150.06 32.19 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.776 ' H ' HD12 ' A' ' 130' ' ' LEU 0.272 0.1 OUTLIER -127.21 153.07 46.55 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 127.036 2.134 . . . . 0.0 105.646 155.199 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 t -141.81 122.89 12.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 103.378 -2.823 . . . . 0.0 103.378 -176.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.4 169.29 17.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.122 0.963 . . . . 0.0 110.181 -176.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.5 p-10 -52.07 -26.73 11.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.675 164.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -2.66 45.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.991 1.269 . . . . 0.0 112.734 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.28 16.06 45.2 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 0.974 . . . . 0.0 114.549 166.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.67 172.25 5.44 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.301 -1.117 . . . . 0.0 108.862 171.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.9 m -146.82 116.55 7.17 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 119.095 -2.253 . . . . 0.0 109.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.615 HD21 ' CG ' ' A' ' 33' ' ' TRP . 0.2 OUTLIER -105.16 161.16 14.5 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.646 1.178 . . . . 0.0 109.816 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 52.5 m -135.05 123.37 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.413 0.685 . . . . 0.0 110.195 -175.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -111.07 151.59 27.89 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 124.066 0.854 . . . . 0.0 111.531 165.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.59 150.4 20.75 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.843 1.257 . . . . 0.0 108.672 153.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -68.7 144.16 54.51 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 165.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.3 t -132.01 85.9 2.29 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 m -79.57 25.76 0.32 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.721 1.208 . . . . 0.0 110.67 167.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 . . . . . 0 C--O 1.247 0.952 0 C-N-CA 127.559 2.344 . . . . 0.0 110.571 -172.491 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -78.22 170.75 18.14 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 CA-C-N 121.176 1.456 . . . . 0.0 111.283 176.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.498 ' HD2' ' H ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -59.66 154.66 17.34 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.68 1.192 . . . . 0.0 110.513 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -108.76 166.12 11.41 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 126.238 1.815 . . . . 0.0 109.206 -177.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -69.6 65.7 1.69 Allowed 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.768 2.312 . . . . 0.0 110.424 164.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -81.17 177.49 8.99 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 126.144 1.777 . . . . 0.0 108.554 163.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 t -165.83 178.34 6.59 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 126.347 1.859 . . . . 0.0 107.773 172.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -85.46 15.78 4.25 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -125.12 82.51 2.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.019 0.928 . . . . 0.0 108.86 -178.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.5 t -136.75 163.64 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.57 163.57 52.91 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.23 1.012 . . . . 0.0 110.668 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -70.98 133.86 24.2 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.882 1.721 . . . . 0.0 108.371 162.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.4 165.29 53.93 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 126.709 2.004 . . . . 0.0 108.729 177.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.43 -165.95 0.25 Allowed 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.041 3.161 . . . . 0.0 111.125 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 65.08 84.06 0.16 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.484 1.913 . . . . 0.0 113.685 170.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -90.6 148.12 37.91 Favored Pre-proline 0 CA--C 1.536 0.434 0 O-C-N 120.764 -1.21 . . . . 0.0 112.624 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -65.0 -36.14 39.65 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.167 2.578 . . . . 0.0 110.498 169.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.7 21.56 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.87 2.068 . . . . 0.0 113.155 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -117.41 -18.58 9.8 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 120.177 -1.577 . . . . 0.0 111.722 169.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.3 m -72.24 -13.51 61.54 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.712 0.687 . . . . 0.0 111.89 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -79.96 2.09 24.9 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.044 1.338 . . . . 0.0 114.289 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.38 2.65 24.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.016 0.927 . . . . 0.0 110.427 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.88 -3.44 25.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.215 1.406 . . . . 0.0 111.964 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.07 -13.7 29.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 128.222 2.609 . . . . 0.0 113.531 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.66 -17.62 3.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.379 1.871 . . . . 0.0 112.582 -169.301 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.2 p -71.23 172.31 9.52 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.343 1.057 . . . . 0.0 111.281 -169.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.49 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 70.2 m -143.24 -57.82 0.41 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.325 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.5 m95 63.75 173.59 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.689 1.596 . . . . 0.0 113.982 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.1 t -142.96 127.45 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 175.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 138' ' ' LEU . 36.2 tp -70.76 138.13 50.21 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -144.3 -20.71 0.55 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.88 155.63 49.54 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 120.595 1.543 . . . . 0.0 109.369 162.301 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -136.25 96.47 3.38 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 104.695 -2.335 . . . . 0.0 104.695 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -100.65 159.03 15.5 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 173.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -104.42 168.14 9.28 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 -174.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.15 -11.76 0.3 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.05 -3.33 12.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.63 1.104 . . . . 0.0 112.704 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.37 8.13 44.49 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 118.394 -1.226 . . . . 0.0 112.204 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.3 m -73.58 99.27 3.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.77 1.785 . . . . 0.0 109.025 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.67 110.92 2.18 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 163.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.9 mtt-85 -65.05 164.32 13.12 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.064 0.935 . . . . 0.0 108.936 169.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.63 144.04 28.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.049 165.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -146.17 163.05 32.43 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.038 2.135 . . . . 0.0 109.61 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.97 115.56 4.36 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 121.682 1.588 . . . . 0.0 109.825 170.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.69 172.77 10.83 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 122.957 0.503 . . . . 0.0 109.876 165.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.05 -44.67 79.06 Favored 'General case' 0 N--CA 1.462 0.168 0 O-C-N 121.61 -0.681 . . . . 0.0 109.943 172.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -65.38 -12.58 53.52 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -76.74 -5.07 46.57 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.579 -1.325 . . . . 0.0 113.095 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.72 -42.94 1.77 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 123.446 0.546 . . . . 0.0 112.407 167.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.89 82.74 63.32 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 125.286 1.435 . . . . 0.0 108.642 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.46 171.63 16.68 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 124.285 3.323 . . . . 0.0 111.452 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.9 mt -93.45 106.55 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 123.866 0.866 . . . . 0.0 109.594 176.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 p -81.59 162.46 23.12 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 166.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.21 163.71 26.11 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -154.89 129.26 9.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.507 -1.371 . . . . 0.0 109.54 178.017 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -135.1 66.2 1.53 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.272 1.429 . . . . 0.0 110.511 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -124.55 -172.86 2.65 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.134 0.974 . . . . 0.0 109.352 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.4 p -106.22 52.91 0.71 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.795 0.838 . . . . 0.0 110.31 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t -67.22 -21.5 65.75 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.984 -1.073 . . . . 0.0 112.76 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -96.4 1.59 51.86 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.404 1.456 . . . . 0.0 111.035 169.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.48 -1.04 10.11 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 126.146 1.831 . . . . 0.0 113.034 -167.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -99.47 172.34 7.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.889 1.844 . . . . 0.0 108.191 151.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -86.79 86.03 7.31 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 125.795 1.638 . . . . 0.0 107.078 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -120.02 106.54 12.11 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.331 1.452 . . . . 0.0 111.358 -162.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 143.69 44.63 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.922 2.089 . . . . 0.0 108.847 172.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.91 176.71 10.84 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 125.499 1.52 . . . . 0.0 108.384 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.68 163.49 20.52 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 73.6 t80 -89.46 109.84 20.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 162.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.5 t -85.62 172.62 10.76 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.396 0.998 . . . . 0.0 108.569 165.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.66 -40.15 6.37 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 126.499 2.0 . . . . 0.0 116.225 -155.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.4 t -116.62 -29.5 6.09 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.171 -0.605 . . . . 0.0 112.048 169.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -131.32 125.0 31.61 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.346 1.07 . . . . 0.0 108.468 -164.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -62.75 151.66 37.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.409 165.323 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -140.39 174.48 10.47 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.571 1.548 . . . . 0.0 109.131 -175.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.4 ptp -154.76 166.28 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 126.079 1.752 . . . . 0.0 109.684 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 167.0 -178.82 41.08 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.184 1.373 . . . . 0.0 111.151 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.6 p -108.86 120.09 41.48 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.951 -1.323 . . . . 0.0 110.963 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.2 p90 -88.94 -173.37 4.06 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -167.18 129.85 1.72 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.751 1.16 . . . . 0.0 109.723 166.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.0 139.28 34.63 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.621 0.646 . . . . 0.0 109.362 172.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 8.3 ptpt -168.94 157.72 8.22 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.409 1.884 . . . . 0.0 109.057 172.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 51.72 41.35 28.98 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.776 1.63 . . . . 0.0 113.735 170.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.11 1.98 11.86 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 120.145 -1.597 . . . . 0.0 114.09 -175.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -123.3 175.86 6.46 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 119.501 1.65 . . . . 0.0 110.731 -176.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 16.7 tp -114.82 124.79 52.64 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.9 p -107.44 153.52 22.69 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -121.31 153.51 37.62 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 125.486 1.515 . . . . 0.0 108.967 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -81.62 -175.43 50.27 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.064 0.84 . . . . 0.0 112.324 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -65.1 105.28 1.03 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 163.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 69.0 mt -88.94 166.71 13.75 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.594 0.757 . . . . 0.0 109.477 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.48 48.0 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.076 163.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -164.06 -121.06 0.55 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 76.6 p -128.15 -174.32 3.18 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.936 1.294 . . . . 0.0 109.944 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.3 mmm180 -130.46 45.46 2.81 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.224 1.81 . . . . 0.0 110.133 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.7 mtm -59.4 155.12 15.42 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.86 128.72 42.99 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 118.047 0.385 . . . . 0.0 111.053 -171.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 58.4 m -134.97 108.66 7.98 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 164.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 8.7 ptp -72.13 68.33 0.71 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 161.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 48.1 p -139.6 153.1 70.02 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.621 1.568 . . . . 0.0 108.394 173.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.88 -29.39 6.94 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.146 1.897 . . . . 0.0 110.561 174.507 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -72.9 -1.53 55.54 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-O 118.019 -1.434 . . . . 0.0 112.664 166.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -86.21 -58.53 1.96 Allowed Glycine 0 C--N 1.336 0.552 0 CA-C-N 119.552 1.676 . . . . 0.0 109.526 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.64 -10.19 43.49 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -167.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 tt -68.58 -15.5 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 O-C-N 121.32 -0.863 . . . . 0.0 111.935 174.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -44.83 -56.79 4.21 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.651 1.58 . . . . 0.0 110.959 173.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.6 -38.31 96.07 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-O 119.522 -0.599 . . . . 0.0 112.045 -177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.93 -41.77 82.03 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 117.696 0.748 . . . . 0.0 110.57 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -58.67 -51.7 68.81 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.231 1.013 . . . . 0.0 110.136 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.42 -42.61 78.3 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -11.02 60.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.76 -23.64 13.78 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 125.23 1.412 . . . . 0.0 111.049 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.88 64.49 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 120.025 1.284 . . . . 0.0 110.772 166.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 42.5 p -73.3 -1.31 17.47 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.17 -0.956 . . . . 0.0 111.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 -132.48 86.31 2.31 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.745 2.018 . . . . 0.0 106.854 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.9 mm -115.86 88.44 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 102.942 -2.984 . . . . 0.0 102.942 167.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -74.06 -42.11 60.7 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.469 -1.292 . . . . 0.0 108.796 169.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 -127.22 173.59 9.61 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.097 0.559 . . . . 0.0 110.98 -175.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 16.0 m -155.29 162.93 40.75 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 119.963 -1.71 . . . . 0.0 108.739 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.54 92.19 0.1 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 125.267 1.413 . . . . 0.0 109.737 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -90.87 135.64 26.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 118.195 0.998 . . . . 0.0 109.345 171.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -106.59 99.0 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 168.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 13.23 1.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.961 1.304 . . . . 0.0 112.697 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.81 132.12 54.44 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 126.782 2.033 . . . . 0.0 107.806 -175.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.91 124.45 58.3 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.273 1.429 . . . . 0.0 110.155 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.25 111.81 2.31 Favored 'Cis proline' 0 N--CA 1.457 -0.674 0 CA-C-N 120.364 1.166 . . . . 0.0 111.055 4.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -70.04 122.07 18.67 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -171.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -136.89 162.19 33.93 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.6 ttp -124.13 136.45 54.22 Favored 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 105.029 -2.211 . . . . 0.0 105.029 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -122.6 132.25 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 58.6 mt -136.55 153.65 50.93 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-O 122.884 1.326 . . . . 0.0 109.133 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.8 m -147.2 161.29 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.399 -3.001 0 CA-C-N 110.324 -3.126 . . . . 0.0 107.594 -160.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 8.4 mp -109.17 -174.58 2.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.494 -1.684 . . . . 0.0 107.56 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.73 -40.74 84.65 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 111.968 171.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -76.51 -20.63 56.73 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.495 0.589 . . . . 0.0 111.136 171.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.98 51.37 6.29 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 124.811 1.196 . . . . 0.0 112.826 -172.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -49.93 171.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 117.916 0.858 . . . . 0.0 109.704 149.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 52.4 m -150.21 92.37 1.87 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 119.601 -1.937 . . . . 0.0 109.685 -163.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.578 HD23 HD11 ' A' ' 30' ' ' LEU . 3.6 mp -100.02 113.38 25.93 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.893 0.877 . . . . 0.0 109.878 -173.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.5 m -77.1 128.15 33.92 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 173.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -124.38 132.23 53.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 164.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -84.21 137.72 33.34 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.211 1.404 . . . . 0.0 108.255 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 132.15 51.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.735 1.152 . . . . 0.0 108.016 173.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' SER . . . . . 0.403 ' C ' ' H ' ' A' ' 145' ' ' ARG . 0.4 OUTLIER -141.38 68.98 1.33 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.917 1.341 . . . . 0.0 107.917 170.83 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 52.3 m -87.31 38.82 0.84 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.759 1.624 . . . . 0.0 106.844 159.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 143' ' ' SER . 47.2 mtt180 . . . . . 0 C--O 1.247 0.96 1 C-N-CA 132.508 4.323 . . . . 0.0 105.063 175.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.593 HG22 ' HE3' ' A' ' 3' ' ' LYS . 2.9 mp . . . . . 0 N--CA 1.471 0.609 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.12 160.61 39.56 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 121.681 1.587 . . . . 0.0 112.12 164.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.593 ' HE3' HG22 ' A' ' 1' ' ' ILE . 14.6 pttp 174.85 77.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.977 2.111 . . . . 0.0 110.846 175.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -114.19 152.62 46.06 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 124.461 1.104 . . . . 0.0 108.573 165.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -72.9 95.59 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.035 0 C-N-CA 123.211 2.608 . . . . 0.0 108.023 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -159.44 165.64 32.7 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 129.787 3.235 . . . . 0.0 105.744 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t 63.44 158.15 0.07 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.519 1.928 . . . . 0.0 110.899 -159.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -145.68 65.73 1.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.646 1.578 . . . . 0.0 106.95 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -153.67 110.62 3.41 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -63.37 108.97 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 157.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.52 156.34 38.63 Favored Pre-proline 0 C--O 1.239 0.552 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -64.86 131.09 27.9 Favored 'Trans proline' 0 N--CA 1.448 -1.199 0 C-N-CA 122.212 1.941 . . . . 0.0 108.051 171.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.93 155.76 91.65 Favored Pre-proline 0 C--O 1.241 0.658 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.51 -179.05 1.74 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.638 2.892 . . . . 0.0 111.593 175.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 69.63 164.57 0.26 Allowed 'General case' 0 C--O 1.235 0.295 0 C-N-CA 127.131 2.172 . . . . 0.0 111.403 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -134.79 143.91 48.37 Favored Pre-proline 0 N--CA 1.435 -1.207 0 C-N-CA 124.805 1.242 . . . . 0.0 108.615 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -70.29 -23.75 28.01 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 122.385 2.057 . . . . 0.0 110.67 166.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.45 14.07 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.841 2.057 . . . . 0.0 113.812 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.588 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -123.65 -12.22 7.68 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.121 2.168 . . . . 0.0 112.286 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.499 HG21 ' C ' ' A' ' 84' ' ' LYS . 3.4 m -82.7 -16.21 48.99 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 119.151 0.887 . . . . 0.0 112.384 -174.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.08 -0.72 22.85 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.82 -1.175 . . . . 0.0 114.141 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.2 3.11 51.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.291 0.636 . . . . 0.0 110.773 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.48 32.78 0.16 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.678 1.991 . . . . 0.0 112.511 -171.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -94.07 -35.35 12.61 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.612 -1.305 . . . . 0.0 111.467 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -141.16 19.86 2.26 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 123.077 1.417 . . . . 0.0 109.868 -165.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.1 p -84.64 -170.58 3.19 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.887 -1.133 . . . . 0.0 108.268 167.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -152.37 -61.46 0.16 Allowed 'General case' 0 CA--C 1.506 -0.712 0 O-C-N 119.326 -2.109 . . . . 0.0 111.642 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 m95 65.9 159.46 0.12 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.81 1.767 . . . . 0.0 115.23 176.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.3 t -135.22 125.05 43.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 128.287 2.635 . . . . 0.0 107.845 174.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.62 126.5 27.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 170.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -126.85 -19.51 4.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 118.887 0.767 . . . . 0.0 112.085 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.08 156.4 43.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.974 -1.079 . . . . 0.0 110.635 163.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -132.1 100.27 4.99 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.95 139.14 33.52 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -80.93 170.59 16.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.73 0.812 . . . . 0.0 109.953 166.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.69 -35.23 74.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.329 0.652 . . . . 0.0 112.341 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -75.9 -12.31 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.601 -0.687 . . . . 0.0 111.824 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.98 14.02 32.39 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-O 118.808 -0.995 . . . . 0.0 113.039 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -79.01 108.99 12.9 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.263 1.531 . . . . 0.0 109.095 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 114.58 5.31 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.406 -0.809 . . . . 0.0 109.102 164.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 -64.61 163.64 13.34 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 124.677 1.191 . . . . 0.0 110.808 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.99 134.14 52.3 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 155.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.6 m -132.01 159.7 70.97 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 166.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.64 114.24 3.43 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.744 1.63 . . . . 0.0 110.983 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -71.22 173.27 7.92 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.185 -0.947 . . . . 0.0 110.288 170.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.76 -35.58 66.37 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.471 -0.768 . . . . 0.0 111.758 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -73.15 -20.9 60.81 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.037 0.535 . . . . 0.0 112.347 -178.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -73.35 -14.56 61.31 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.619 -0.676 . . . . 0.0 112.006 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.74 -19.46 54.53 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 124.398 0.999 . . . . 0.0 114.397 167.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -131.53 71.09 81.48 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 123.967 0.907 . . . . 0.0 109.738 171.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -63.21 156.95 52.37 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 122.223 1.948 . . . . 0.0 110.057 172.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.7 mt -89.8 134.9 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -130.51 165.5 22.55 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -135.14 155.04 51.38 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 175.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.2 m -151.73 115.15 4.8 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.387 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.7 113.56 25.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 170.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -161.75 -174.42 4.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.6 p -134.29 27.82 3.77 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.533 1.133 . . . . 0.0 112.116 -171.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 63.8 m -44.93 -36.48 3.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.052 1.741 . . . . 0.0 114.286 172.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.9 t -72.96 -28.75 62.59 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.669 1.122 . . . . 0.0 111.143 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.01 -23.54 5.54 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 127.536 2.494 . . . . 0.0 111.962 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 -117.57 172.21 7.49 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.852 1.661 . . . . 0.0 109.57 177.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -61.57 93.46 0.04 OUTLIER 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.262 1.025 . . . . 0.0 110.552 167.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -131.06 120.63 23.7 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 126.546 1.938 . . . . 0.0 107.14 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.94 30.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.985 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.2 p -152.79 174.25 14.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 159.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 163.89 -165.3 36.92 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 174.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -121.12 127.66 51.81 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -93.78 -7.15 44.31 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.246 1.418 . . . . 0.0 112.784 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 143.67 -44.8 0.92 Allowed Glycine 0 C--N 1.336 0.556 0 CA-C-N 118.382 0.537 . . . . 0.0 112.005 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 5.4 p -157.98 -32.03 0.07 Allowed 'General case' 0 CA--C 1.52 -0.201 0 O-C-N 120.86 -1.376 . . . . 0.0 111.717 173.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.63 -0.02 46.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -173.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . 0.278 0.8 OUTLIER 48.01 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 127.471 2.308 . . . . 0.0 113.385 -175.211 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -154.53 164.97 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.498 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.28 173.73 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.493 2.717 . . . . 0.0 107.707 167.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 148.53 174.69 20.44 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 125.628 1.585 . . . . 0.0 110.146 170.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.5 p -71.93 169.18 16.4 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.714 0.769 . . . . 0.0 110.755 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -148.99 174.78 11.91 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.471 0.708 . . . . 0.0 109.334 167.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.94 148.62 23.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.871 1.268 . . . . 0.0 108.983 169.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 114.4 26.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -151.11 166.26 31.35 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 53.55 13.4 0.47 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.233 1.813 . . . . 0.0 115.463 174.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.43 17.34 78.92 Favored Glycine 0 CA--C 1.531 1.059 0 O-C-N 120.495 -1.378 . . . . 0.0 112.56 -170.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.499 ' C ' HG21 ' A' ' 20' ' ' THR . 10.9 pttt -131.33 179.24 6.14 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 127.195 2.198 . . . . 0.0 110.129 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.05 109.39 20.82 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 104.433 -2.432 . . . . 0.0 104.433 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 57.6 p -97.45 152.82 18.58 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.019 0.827 . . . . 0.0 109.629 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.0 -164.81 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 110.266 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.9 -156.68 8.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 125.931 1.729 . . . . 0.0 111.595 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 t -74.71 71.03 1.91 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 172.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.1 mt -66.36 155.06 38.42 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.54 1.136 . . . . 0.0 108.096 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.85 -175.88 43.62 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 169.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.15 -149.72 5.18 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-O 121.794 0.663 . . . . 0.0 111.558 -167.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.3 p -100.18 -172.14 2.16 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 124.227 1.011 . . . . 0.0 109.993 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 mmt180 -135.5 87.84 2.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 171.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.3 mtt -114.42 165.2 12.97 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.633 1.173 . . . . 0.0 110.075 173.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.57 150.43 47.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 122.774 1.273 . . . . 0.0 110.602 163.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -145.09 147.16 32.24 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 130.411 3.484 . . . . 0.0 106.637 163.8 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ptp -129.09 28.6 5.27 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.953 1.701 . . . . 0.0 109.835 -177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.7 p -132.02 154.22 81.63 Favored Pre-proline 0 N--CA 1.446 -0.666 0 C-N-CA 125.953 1.701 . . . . 0.0 107.663 -168.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.15 -41.93 11.89 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.303 1.335 . . . . 0.0 109.348 176.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -62.51 -17.14 56.51 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-O 118.003 -1.443 . . . . 0.0 113.268 176.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.86 -56.11 12.01 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 120.102 1.951 . . . . 0.0 110.869 167.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -73.94 -18.39 60.9 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.471 1.136 . . . . 0.0 113.047 -162.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 18.2 tt -66.77 -13.72 16.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 123.278 0.631 . . . . 0.0 111.403 172.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -50.06 -43.24 51.06 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 125.426 1.49 . . . . 0.0 111.439 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.71 -42.6 98.01 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-O 119.417 -0.657 . . . . 0.0 111.611 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.61 69.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.632 0.716 . . . . 0.0 109.638 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.72 -54.48 38.61 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.993 0.917 . . . . 0.0 110.477 -175.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.48 -50.05 66.18 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 174.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -48.31 74.23 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.89 0.314 . . . . 0.0 111.225 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.01 64.43 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.232 1.013 . . . . 0.0 112.88 -173.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.08 -14.72 61.45 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.782 1.174 . . . . 0.0 112.293 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 26.4 p -84.46 4.39 31.89 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 119.287 0.949 . . . . 0.0 111.368 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -133.38 80.88 1.9 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.43 2.292 . . . . 0.0 108.659 -171.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -118.03 51.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 119.331 0.969 . . . . 0.0 109.959 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.95 -32.58 73.02 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.973 -1.079 . . . . 0.0 111.622 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -128.32 168.09 16.02 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.182 1.393 . . . . 0.0 109.789 -175.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 t -162.97 -179.01 6.44 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.598 -164.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 172.3 69.79 0.04 OUTLIER Glycine 0 CA--C 1.534 1.221 0 CA-C-N 118.993 0.815 . . . . 0.0 114.279 -176.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.588 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.0 p -85.15 142.05 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-N 120.797 2.298 . . . . 0.0 109.078 171.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -105.76 96.2 6.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 166.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.565 ' HB2' ' HB1' ' A' ' 19' ' ' ALA . 32.2 tpp -81.96 60.62 4.88 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 171.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 110.14 2.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -48.23 132.34 12.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.893 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.57 119.82 5.5 Favored 'Cis proline' 0 C--N 1.347 0.493 0 CA-C-N 119.543 0.872 . . . . 0.0 111.3 -0.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.07 136.69 37.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -140.91 165.87 26.34 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.82 2.448 . . . . 0.0 105.605 171.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 27.7 ttp -131.29 128.88 40.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 174.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -112.62 146.39 38.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 169.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 37.5 mt -135.11 139.99 45.12 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 73.9 t -129.07 126.24 64.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 -168.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.9 mp -73.95 165.92 24.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 122.666 1.222 . . . . 0.0 108.733 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -58.01 -36.12 72.22 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.724 1.21 . . . . 0.0 109.892 167.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -72.04 -19.86 61.77 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.895 1.678 . . . . 0.0 110.498 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.44 12.54 57.06 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-O 118.307 -1.274 . . . . 0.0 114.388 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.33 145.59 47.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.09 1.945 . . . . 0.0 107.423 164.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 15.1 m -125.12 96.6 4.91 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 124.947 1.299 . . . . 0.0 109.163 -177.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.54 127.58 33.0 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.072 -1.018 . . . . 0.0 108.333 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 36.7 m -113.95 118.52 34.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.391 1.877 . . . . 0.0 107.644 -175.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -114.74 150.58 35.12 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.148 1.379 . . . . 0.0 108.785 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.13 149.3 21.57 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.279 1.031 . . . . 0.0 108.986 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.0 tpt85 -71.48 107.11 4.23 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 163.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.68 89.03 2.97 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 170.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 t -115.57 50.34 1.01 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 122.038 0.923 . . . . 0.0 108.91 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.019 -1.467 . . . . 0.0 107.778 -179.213 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 13.1 pt . . . . . 0 N--CA 1.468 0.444 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.59 -173.35 0.68 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.796 2.998 . . . . 0.0 111.238 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.94 169.4 0.23 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.9 1.28 . . . . 0.0 113.015 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -123.43 165.31 23.4 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 127.385 2.274 . . . . 0.0 108.655 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.48 82.46 2.39 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.946 2.43 . . . . 0.0 109.914 175.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -142.1 -169.51 2.95 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.912 1.685 . . . . 0.0 109.373 173.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.8 m -44.85 110.66 0.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.616 2.366 . . . . 0.0 114.753 -176.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -77.46 62.64 2.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.774 1.23 . . . . 0.0 107.7 159.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -136.14 34.33 2.82 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.306 1.042 . . . . 0.0 112.289 176.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -137.7 140.65 40.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 124.702 1.201 . . . . 0.0 110.003 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.09 150.45 8.08 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.035 1.334 . . . . 0.0 110.784 175.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.24 131.46 17.87 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.496 2.131 . . . . 0.0 111.704 -168.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.52 144.53 89.0 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 171.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.32 -164.56 0.12 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.399 3.399 . . . . 0.0 112.256 177.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 70.8 35.17 1.83 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.077 1.751 . . . . 0.0 111.585 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.07 144.71 58.2 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.215 1.406 . . . . 0.0 111.175 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.18 -26.15 5.36 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.634 2.89 . . . . 0.0 111.474 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.69 30.32 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.114 1.365 . . . . 0.0 112.538 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.405 ' HB1' ' SD ' ' A' ' 122' ' ' MET . . . -120.71 -11.06 9.08 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.303 2.641 . . . . 0.0 110.558 173.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -59.63 -39.17 83.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.122 0.969 . . . . 0.0 112.389 -169.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -28.16 69.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.675 -1.265 . . . . 0.0 113.072 177.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.3 mp -81.86 34.68 0.4 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.947 1.699 . . . . 0.0 110.108 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.35 -6.45 17.16 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.461 1.105 . . . . 0.0 110.898 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -60.77 -27.81 68.26 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.294 1.837 . . . . 0.0 114.901 -166.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -102.14 -14.09 17.2 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.621 1.568 . . . . 0.0 113.083 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.2 p -89.43 174.88 7.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.756 -149.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 3.9 p -124.12 -73.96 0.63 Allowed 'General case' 0 CA--C 1.503 -0.84 0 O-C-N 121.13 -0.981 . . . . 0.0 112.388 -171.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 6.6 m95 69.82 162.68 0.23 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.584 1.954 . . . . 0.0 111.421 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.6 t -144.3 135.3 21.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 177.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.23 131.85 40.67 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.9 t -116.96 -26.17 6.97 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.626 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -153.87 146.38 24.07 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 121.325 1.875 . . . . 0.0 112.458 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.698 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -137.98 101.63 4.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 127.808 2.443 . . . . 0.0 107.36 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -84.8 131.87 34.49 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 169.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.82 167.12 17.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 163.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.28 -29.72 66.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.114 0.884 . . . . 0.0 112.459 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.29 -16.83 28.52 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.757 0.708 . . . . 0.0 112.582 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.2 -1.81 11.56 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.703 1.144 . . . . 0.0 113.4 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 m -64.33 93.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.667 1.734 . . . . 0.0 109.096 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.4 107.22 0.63 Allowed 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.677 -1.264 . . . . 0.0 109.719 169.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.45 142.75 57.73 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.776 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.63 130.94 41.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.7 m -128.77 153.88 79.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 174.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -70.1 113.32 3.39 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.129 1.219 . . . . 0.0 110.26 -177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -62.14 169.15 2.88 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.338 0.655 . . . . 0.0 110.664 166.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.35 62.53 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.978 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -102.01 -9.26 20.77 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -68.81 -15.26 63.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.268 -0.872 . . . . 0.0 112.024 173.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.67 -79.57 0.28 Allowed Glycine 0 C--N 1.336 0.551 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.26 86.18 58.58 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 128.211 2.604 . . . . 0.0 108.13 -168.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.85 160.21 47.89 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.443 2.096 . . . . 0.0 111.594 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 108' ' ' TYR . 26.6 mt -75.17 103.56 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 176.257 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 p -103.29 157.81 16.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.599 0.759 . . . . 0.0 109.644 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -127.21 157.92 38.51 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.516 1.127 . . . . 0.0 109.223 169.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -141.7 128.15 20.06 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.547 1.539 . . . . 0.0 108.328 163.205 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.98 121.13 38.53 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 126.457 1.903 . . . . 0.0 106.159 161.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -151.57 -167.72 2.88 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 173.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 p -131.26 21.82 4.81 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.755 1.622 . . . . 0.0 111.277 -171.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.3 t -63.28 -29.76 71.03 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.226 1.41 . . . . 0.0 113.819 -165.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -78.99 -10.73 59.92 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.098 -1.001 . . . . 0.0 111.346 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.16 -6.35 58.07 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 125.803 1.668 . . . . 0.0 111.667 -169.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -132.3 166.93 20.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.533 1.533 . . . . 0.0 110.215 -176.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.2 ptp85 -66.04 74.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.815 2.046 . . . . 0.0 111.944 173.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.25 140.9 36.78 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.39 148.11 38.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.3 p -152.3 166.75 30.83 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.58 -169.4 40.4 Favored Glycine 0 C--N 1.331 0.29 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.26 132.96 51.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 169.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.2 m -114.52 22.88 13.24 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.475 1.91 . . . . 0.0 110.836 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.56 -73.5 0.46 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-O 117.287 -1.84 . . . . 0.0 112.08 178.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -144.51 -4.92 0.76 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 121.579 2.69 . . . . 0.0 113.878 179.591 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.433 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 16.3 m120 -115.97 -6.27 11.99 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.226 1.411 . . . . 0.0 114.268 -172.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 61.98 174.86 0.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 131.493 3.917 . . . . 0.0 111.74 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -147.68 161.2 41.65 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.369 0.604 . . . . 0.0 111.719 170.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.8 164.83 37.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.576 2.351 . . . . 0.0 108.266 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.07 173.98 27.18 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 174.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.0 p -89.33 160.64 16.77 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 122.123 -0.633 . . . . 0.0 109.755 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -140.26 -174.62 3.99 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.756 -0.59 . . . . 0.0 111.75 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -153.19 165.76 34.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.627 1.571 . . . . 0.0 108.542 166.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 79.5 mt -128.88 105.43 8.22 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -163.08 170.34 18.08 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 126.181 1.792 . . . . 0.0 108.65 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.62 21.7 7.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.061 1.344 . . . . 0.0 112.966 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.36 19.88 64.8 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 118.467 -1.185 . . . . 0.0 112.653 -171.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -139.78 178.74 7.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.397 1.599 . . . . 0.0 111.19 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 tt -115.41 113.37 23.66 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.14 134.09 36.95 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 170.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -88.69 -172.78 3.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.08 -149.01 7.91 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 126.664 2.078 . . . . 0.0 109.641 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.0 t -61.56 110.34 1.45 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 mt -88.21 169.62 11.72 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.333 1.453 . . . . 0.0 109.4 171.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.55 177.59 46.51 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 158.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.1 -173.68 25.84 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 70.1 p -71.4 179.45 2.94 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.889 0.876 . . . . 0.0 111.425 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.49 47.65 2.51 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.183 1.393 . . . . 0.0 108.297 172.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.7 mtm -63.1 157.08 23.15 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -112.1 129.82 56.1 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 96.9 m -136.71 125.74 24.4 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.883 2.073 . . . . 0.0 108.319 -169.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.5 mtp -90.73 53.06 2.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.994 0.902 . . . . 0.0 109.795 -174.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.7 p -134.55 153.29 78.99 Favored Pre-proline 0 C--O 1.239 0.507 0 C-N-CA 124.394 1.077 . . . . 0.0 108.25 -170.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -72.63 -37.77 3.78 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.257 1.305 . . . . 0.0 108.883 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.07 15.64 6.36 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 118.056 -1.413 . . . . 0.0 111.933 172.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -113.19 -11.0 14.3 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-N 120.504 2.152 . . . . 0.0 111.855 163.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -88.39 -21.06 24.5 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 169.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.4 tt -71.16 -14.1 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 120.093 1.315 . . . . 0.0 113.179 -169.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -57.34 -41.44 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 121.004 -1.06 . . . . 0.0 112.516 -172.346 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.12 -47.44 87.57 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 124.346 0.974 . . . . 0.0 111.249 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.39 -51.42 67.62 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.755 0.778 . . . . 0.0 109.678 177.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.413 ' CE1' HG21 ' A' ' 52' ' ' ILE . 52.1 t80 -64.5 -40.57 95.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.487 0.315 . . . . 0.0 111.359 -170.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.3 mp -61.5 -37.19 82.78 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 121.256 -0.903 . . . . 0.0 110.467 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -21.16 65.07 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.36 -39.74 20.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.0 -13.5 35.99 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.134 0.974 . . . . 0.0 113.141 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 46.9 p -97.84 8.89 43.96 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.01 1.324 . . . . 0.0 110.838 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -134.96 65.21 1.57 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 109.637 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -100.85 79.37 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 169.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.83 -36.52 78.3 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 118.699 -1.2 . . . . 0.0 110.211 170.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.588 ' HG2' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -130.69 161.27 32.02 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.444 1.098 . . . . 0.0 110.966 -174.701 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.6 m -149.25 169.74 20.06 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 158.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -159.71 162.16 32.79 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 108.09 -2.004 . . . . 0.0 108.09 153.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 45.0 t -124.74 145.04 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 43.5 tt0 -110.08 93.3 4.43 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 170.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.405 ' SD ' ' HB1' ' A' ' 19' ' ' ALA . 18.2 mtp -80.2 35.2 0.32 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.442 1.097 . . . . 0.0 111.495 176.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -132.12 124.71 29.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 -178.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.62 148.83 65.17 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.973 0.909 . . . . 0.0 110.573 -173.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.9 122.39 5.6 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 N-CA-C 108.895 -1.233 . . . . 0.0 108.895 -14.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -71.52 135.24 46.99 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.11 0.481 . . . . 0.0 110.705 -168.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -139.26 168.81 18.99 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.799 1.24 . . . . 0.0 109.282 174.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -132.2 143.63 50.08 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.666 1.986 . . . . 0.0 106.843 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -138.01 139.39 39.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.883 0.849 . . . . 0.0 110.333 -174.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.79 ' H ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -134.09 161.12 35.75 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 127.675 2.39 . . . . 0.0 109.516 176.881 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.588 ' HB ' ' HG2' ' A' ' 117' ' ' ARG . 25.2 t -133.54 136.55 54.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 103.642 -2.725 . . . . 0.0 103.642 172.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 1.4 mp -82.71 162.1 21.89 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 172.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -66.11 -26.57 67.52 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.483 0.659 . . . . 0.0 111.731 -173.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.36 -5.92 58.36 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.615 1.566 . . . . 0.0 111.619 176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 103.22 4.41 47.38 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.997 -1.446 . . . . 0.0 115.441 169.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -62.07 158.46 16.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.589 1.695 . . . . 0.0 109.25 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.0 m -128.54 115.25 17.83 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.806 1.242 . . . . 0.0 109.981 -176.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.698 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.2 mm? -116.03 152.23 33.96 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.722 -0.611 . . . . 0.0 109.61 -177.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 98.1 m -145.49 119.79 9.58 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.567 -164.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.571 ' CE1' HD11 ' A' ' 130' ' ' LEU . 78.0 m-85 -113.82 140.25 48.47 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 123.518 0.727 . . . . 0.0 110.28 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.4 136.11 33.98 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.415 1.486 . . . . 0.0 107.708 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -60.91 136.93 58.23 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 117.803 -1.094 . . . . 0.0 108.21 174.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.0 t -138.42 35.91 2.27 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 119.661 1.118 . . . . 0.0 111.189 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.9 m -76.75 25.21 0.14 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.943 1.297 . . . . 0.0 109.822 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.7 ttt180 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 127.85 2.46 . . . . 0.0 111.736 171.552 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 23.6 pt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 110.573 -0.158 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -72.81 169.36 22.23 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 122.311 2.008 . . . . 0.0 110.502 172.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -127.18 -29.78 2.72 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.717 1.207 . . . . 0.0 110.101 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -137.37 165.85 31.24 Favored Pre-proline 0 CA--C 1.534 0.357 0 C-N-CA 128.307 2.643 . . . . 0.0 107.634 171.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.73 -22.24 73.74 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.465 1.443 . . . . 0.0 113.103 178.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.2 t0 75.12 65.59 0.07 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.494 2.718 . . . . 0.0 109.184 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.4 m -157.14 169.03 25.72 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.542 1.537 . . . . 0.0 110.465 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.47 58.52 4.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 127.242 2.217 . . . . 0.0 108.799 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.71 40.41 1.08 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.204 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -148.28 151.3 13.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.12 155.76 91.39 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.527 0.731 . . . . 0.0 110.541 173.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.04 129.93 20.51 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.677 2.251 . . . . 0.0 110.91 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -67.68 144.33 97.46 Favored Pre-proline 0 C--O 1.241 0.627 0 C-N-CA 125.07 1.348 . . . . 0.0 109.975 -175.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.94 179.59 4.22 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.15 2.567 . . . . 0.0 112.042 -172.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 64.86 64.76 0.64 Allowed 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 125.386 1.474 . . . . 0.0 109.641 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -112.0 144.14 30.13 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.749 -170.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.46 -26.42 14.22 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.049 3.166 . . . . 0.0 111.902 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.77 49.82 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.584 171.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -156.16 -43.57 0.08 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.919 2.487 . . . . 0.0 108.26 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 m -60.8 -16.9 45.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.994 2.517 . . . . 0.0 114.206 -164.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -74.44 -24.05 59.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.943 1.697 . . . . 0.0 113.466 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -72.42 -4.42 30.08 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.467 1.507 . . . . 0.0 111.155 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 38.98 0.57 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.875 1.27 . . . . 0.0 111.278 -160.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.77 -51.54 7.14 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.692 0.797 . . . . 0.0 110.756 175.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.07 -3.09 28.16 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.211 1.004 . . . . 0.0 112.232 -158.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.61 167.24 11.6 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 123.059 1.409 . . . . 0.0 111.584 -156.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.9 p -141.72 155.69 45.64 Favored 'General case' 0 CA--C 1.496 -1.122 0 O-C-N 120.07 -1.644 . . . . 0.0 106.822 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.723 ' CD1' HD13 ' A' ' 54' ' ' LEU . 9.1 m95 -145.62 169.07 19.16 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.433 -175.142 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.0 t -136.02 124.03 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 169.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 52' ' ' ILE . 2.0 tm? -79.98 129.82 34.79 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 -7.78 3.57 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.91 141.7 19.05 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-N 119.666 1.121 . . . . 0.0 111.389 173.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.605 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -127.47 118.81 24.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 128.562 2.745 . . . . 0.0 106.19 174.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -98.71 130.75 45.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -66.28 168.26 9.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 118.359 0.527 . . . . 0.0 109.793 163.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.13 71.61 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.479 1.111 . . . . 0.0 112.14 -174.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -23.57 63.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.811 0.339 . . . . 0.0 110.733 -177.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 110.33 3.14 29.4 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.663 2.078 . . . . 0.0 112.248 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.6 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.049 1.424 . . . . 0.0 108.807 177.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.14 115.92 4.15 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 168.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.44 168.87 15.21 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.082 0.553 . . . . 0.0 109.623 172.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.75 152.3 27.06 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 151.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.42 ' HB ' ' HD2' ' A' ' 44' ' ' PRO . 23.4 m -140.36 165.65 28.79 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 125.983 1.713 . . . . 0.0 108.492 170.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 43' ' ' VAL . 19.5 Cg_endo -66.46 105.77 0.94 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.005 2.47 . . . . 0.0 110.454 169.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.444 ' H ' ' HG3' ' A' ' 48' ' ' GLN . 0.7 OUTLIER -73.18 174.87 7.37 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.563 1.145 . . . . 0.0 111.352 167.798 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.76 -49.33 76.93 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.932 0.493 . . . . 0.0 112.241 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.24 3.96 52.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.444 ' HG3' ' H ' ' A' ' 45' ' ' SER . 27.3 mm-40 -70.22 -24.99 63.19 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.328 -0.857 . . . . 0.0 110.641 171.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.66 -44.38 0.72 Allowed Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.306 0.955 . . . . 0.0 112.533 173.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.29 85.44 5.41 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 127.198 2.199 . . . . 0.0 109.953 -165.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -69.53 138.6 38.94 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 123.176 2.584 . . . . 0.0 112.807 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 30' ' ' LEU . 3.4 mt -62.95 119.43 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.927 0.891 . . . . 0.0 109.61 163.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -124.37 119.28 28.79 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 172.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.723 HD13 ' CD1' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -72.35 144.23 48.34 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.911 1.284 . . . . 0.0 108.608 173.651 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.9 m -148.77 103.02 3.34 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 166.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.502 HD22 HD22 ' A' ' 54' ' ' LEU . 1.6 mm? -82.26 126.81 32.54 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 162.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.7 t -170.25 -159.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.89 51.2 1.13 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.932 0.893 . . . . 0.0 112.231 171.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.1 t -57.88 -39.5 77.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.395 1.078 . . . . 0.0 112.526 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.51 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 3.6 t -81.33 -10.93 59.46 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.571 0.748 . . . . 0.0 112.361 174.001 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.09 -12.25 40.77 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.177 1.37 . . . . 0.0 112.87 -173.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -120.87 162.32 20.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.591 1.695 . . . . 0.0 110.168 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.4 ptp85 -63.06 94.97 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.553 0.741 . . . . 0.0 110.861 176.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.51 ' CE1' ' HB ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -138.7 154.41 48.58 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.144 0.973 . . . . 0.0 109.284 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.96 92.86 9.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -169.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.2 p -98.09 66.49 1.83 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 122.257 1.027 . . . . 0.0 109.84 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.06 161.29 26.63 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 29.4 t80 -88.0 119.41 28.34 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 157.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -83.92 176.57 8.79 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 160.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.77 11.16 6.1 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.958 1.266 . . . . 0.0 115.374 -155.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -159.38 3.29 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 141.659 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 24.8 m-20 -135.84 125.69 25.73 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 106.135 -1.802 . . . . 0.0 106.135 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.549 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -69.5 139.61 53.88 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.772 -0.58 . . . . 0.0 110.03 168.599 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -112.74 169.04 9.18 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 126.236 1.814 . . . . 0.0 108.86 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.7 ptp -157.5 146.47 19.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.054 1.742 . . . . 0.0 107.516 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.56 156.33 7.97 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.571 -0.612 . . . . 0.0 111.571 168.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -94.83 120.5 35.15 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 122.613 0.365 . . . . 0.0 111.969 -146.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.501 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 41.3 p90 -98.0 171.09 8.49 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.195 0.522 . . . . 0.0 112.175 -169.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.51 145.67 25.35 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 126.738 2.015 . . . . 0.0 107.993 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.73 117.43 29.32 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 170.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -159.23 3.12 0.09 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -173.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -137.82 9.65 2.84 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.088 0.955 . . . . 0.0 113.454 -161.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.97 11.4 50.93 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.252 -1.53 . . . . 0.0 112.01 -157.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -137.87 165.94 25.25 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 126.93 2.092 . . . . 0.0 109.49 169.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -75.08 146.52 41.4 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 128.362 2.665 . . . . 0.0 107.375 163.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m -127.47 138.14 52.87 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 153.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -85.48 164.12 18.03 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.14 -171.65 44.45 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.108 -1.997 . . . . 0.0 108.108 165.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 m -58.37 106.53 0.39 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 165.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.4 mt -82.81 156.37 23.69 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -154.2 167.01 32.27 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 165.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.09 179.46 21.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.613 0.707 . . . . 0.0 111.901 -174.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.0 p -67.18 172.13 5.01 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -120.52 77.34 1.26 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 169.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 30.5 mtt -76.86 158.78 30.55 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -98.11 111.89 24.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.219 1.408 . . . . 0.0 108.243 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 77.9 m -145.58 129.08 16.99 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.847 0.832 . . . . 0.0 110.998 -167.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.3 mtm -107.54 57.17 0.63 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.115 1.766 . . . . 0.0 107.521 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.8 p -142.58 150.79 55.49 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 123.34 0.656 . . . . 0.0 110.396 -164.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.99 -21.76 31.98 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.26 1.974 . . . . 0.0 111.236 176.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.86 -14.88 68.88 Favored Glycine 0 CA--C 1.524 0.645 0 C-N-CA 124.723 1.154 . . . . 0.0 112.935 173.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 -38.98 68.67 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 118.582 1.191 . . . . 0.0 111.411 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -92.5 -26.24 18.04 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.621 0.71 . . . . 0.0 112.445 -173.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.72 -14.15 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 119.388 0.995 . . . . 0.0 111.451 174.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -50.34 -43.87 54.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.121 0.969 . . . . 0.0 110.551 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.84 97.56 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.565 -0.614 . . . . 0.0 111.565 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.89 -37.11 75.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 117.622 0.711 . . . . 0.0 110.522 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -62.47 -48.77 78.14 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.567 0.747 . . . . 0.0 109.992 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.0 -33.04 74.57 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.89 0.768 . . . . 0.0 110.737 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.22 -32.96 74.71 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.964 0.802 . . . . 0.0 111.992 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.73 72.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 123.367 0.667 . . . . 0.0 109.545 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -13.8 50.24 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 117.435 -1.269 . . . . 0.0 113.574 175.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 p -79.9 -9.46 59.68 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 121.012 1.733 . . . . 0.0 111.686 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -121.14 26.78 8.78 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.458 1.103 . . . . 0.0 112.386 -163.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.2 mm -68.54 90.92 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -90.13 -25.56 20.64 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 121.569 -0.707 . . . . 0.0 111.108 169.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -133.87 166.65 22.19 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 126.167 1.787 . . . . 0.0 110.307 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 m -160.21 146.59 15.67 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.54 1.536 . . . . 0.0 107.932 174.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -125.37 138.06 10.71 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 160.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.41 144.24 23.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 164.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -124.79 76.99 1.56 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 -173.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.5 mtp -81.16 27.31 0.41 Allowed 'General case' 0 C--O 1.23 0.069 0 C-N-CA 126.314 1.846 . . . . 0.0 113.821 -174.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -121.51 109.06 14.37 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -51.52 126.22 29.53 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 124.271 1.029 . . . . 0.0 110.629 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.39 120.59 6.58 Favored 'Cis proline' 0 CA--C 1.534 0.52 0 O-C-N 122.63 0.805 . . . . 0.0 112.725 6.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -82.95 137.57 34.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.835 -0.541 . . . . 0.0 110.409 -170.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -142.51 175.85 9.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 107.573 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' MET . . . . . 0.414 ' HB2' ' CE3' ' A' ' 28' ' ' TRP . 7.1 tmm? -128.25 157.44 40.88 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 126.725 2.01 . . . . 0.0 105.937 172.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -155.15 112.03 3.27 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 169.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.834 HD11 ' HB2' ' A' ' 138' ' ' LEU 0.333 0.4 OUTLIER -80.97 163.94 22.93 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 172.627 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.9 t -135.93 130.99 49.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 104.74 -2.319 . . . . 0.0 104.74 166.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 14.5 mt -83.11 164.8 20.03 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -54.7 -37.08 65.38 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.21 1.004 . . . . 0.0 111.679 173.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -80.22 -14.57 58.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.342 1.057 . . . . 0.0 111.993 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.38 -7.61 34.68 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.603 1.097 . . . . 0.0 114.613 174.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -55.02 144.65 22.75 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.265 1.532 . . . . 0.0 108.666 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.3 m -135.54 110.94 9.09 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 125.294 1.438 . . . . 0.0 108.013 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.834 ' HB2' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -105.86 155.83 18.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 121.254 -0.903 . . . . 0.0 108.938 176.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 89.5 m -132.78 114.93 14.69 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.094 1.497 . . . . 0.0 108.946 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.409 ' CD1' ' HE3' ' A' ' 128' ' ' MET . 8.7 m-85 -124.81 139.54 53.75 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -175.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.3 OUTLIER -93.79 142.65 27.13 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 123.787 0.835 . . . . 0.0 109.078 178.706 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -65.68 119.5 11.28 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 116.382 -1.771 . . . . 0.0 109.694 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 5.7 t -124.08 38.34 4.21 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.671 2.032 . . . . 0.0 113.217 -172.145 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.3 p -74.89 17.2 0.23 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.753 1.221 . . . . 0.0 112.214 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.973 0 C-N-CA 125.118 1.367 . . . . 0.0 113.292 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.3 pt . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.4 160.72 34.07 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.777 2.318 . . . . 0.0 112.017 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.03 -179.48 6.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.223 2.209 . . . . 0.0 107.394 173.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -89.51 165.11 27.03 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.305 1.042 . . . . 0.0 108.953 174.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.22 -10.52 29.19 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 122.791 2.328 . . . . 0.0 113.64 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 60.67 64.38 1.18 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.755 2.022 . . . . 0.0 111.503 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 t 75.13 -175.41 0.13 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.061 2.144 . . . . 0.0 110.928 177.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -110.68 63.19 0.61 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.913 1.285 . . . . 0.0 107.768 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.88 70.39 1.3 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.4 m -101.2 76.39 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 126.126 1.771 . . . . 0.0 107.467 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.7 154.94 33.08 Favored Pre-proline 0 CA--C 1.535 0.384 0 O-C-N 121.309 -0.869 . . . . 0.0 110.226 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.17 148.26 91.27 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 122.022 1.815 . . . . 0.0 108.214 177.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' CG ' ' HD2' ' A' ' 14' ' ' PRO . 2.1 t70 -92.89 159.82 35.16 Favored Pre-proline 0 C--O 1.241 0.635 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.466 ' HD2' ' CG ' ' A' ' 13' ' ' ASP . 45.9 Cg_endo -69.79 -172.3 0.57 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.555 2.837 . . . . 0.0 111.815 -177.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 75.27 159.26 0.22 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 128.08 2.552 . . . . 0.0 112.33 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -147.39 149.79 35.55 Favored Pre-proline 0 CA--C 1.532 0.269 0 O-C-N 121.591 -0.693 . . . . 0.0 111.052 179.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.37 -32.34 8.2 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 123.891 3.06 . . . . 0.0 111.103 170.007 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.3 40.78 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.007 2.123 . . . . 0.0 112.243 175.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.626 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -143.03 -17.26 0.67 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.845 1.658 . . . . 0.0 112.069 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -31.64 72.22 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.49 1.496 . . . . 0.0 111.272 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -57.73 -20.47 34.8 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -173.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.33 6.23 38.16 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.638 1.175 . . . . 0.0 111.158 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -89.97 78.09 6.8 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.404 1.482 . . . . 0.0 108.373 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -134.45 -27.78 1.33 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -128.24 0.93 5.77 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.954 1.702 . . . . 0.0 111.118 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.9 p -74.27 -172.76 1.5 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 125.692 1.597 . . . . 0.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.697 ' OG ' HG23 ' A' ' 55' ' ' THR . 0.4 OUTLIER -151.24 -63.9 0.19 Allowed 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.453 -1.404 . . . . 0.0 110.536 -176.41 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.2 m95 65.12 159.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 123.227 1.489 . . . . 0.0 112.438 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.5 t -140.97 129.61 24.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 103.744 -2.687 . . . . 0.0 103.744 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.431 HD13 ' CE2' ' A' ' 140' ' ' PHE . 39.6 tp -66.91 154.8 40.11 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 172.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.09 -20.8 0.25 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.46 -1.4 . . . . 0.0 111.67 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.26 140.05 29.0 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 118.753 0.706 . . . . 0.0 109.824 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -118.03 98.61 6.41 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.536 1.134 . . . . 0.0 108.442 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.55 134.33 34.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -74.96 166.96 22.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 123.011 0.524 . . . . 0.0 109.599 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.38 16.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 129.395 3.078 . . . . 0.0 115.226 172.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.6 -18.38 3.53 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.377 2.271 . . . . 0.0 111.202 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.14 3.99 35.74 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.255 0.931 . . . . 0.0 113.914 -175.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.7 m -88.08 113.27 23.55 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.615 1.566 . . . . 0.0 111.747 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.48 108.82 2.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.767 1.227 . . . . 0.0 113.343 165.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.11 161.51 8.53 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 126.096 1.758 . . . . 0.0 112.09 176.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 128.65 38.15 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 117.995 -1.002 . . . . 0.0 108.59 161.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.46 163.57 33.45 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 126.027 1.731 . . . . 0.0 108.318 174.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.2 107.59 2.23 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.652 2.235 . . . . 0.0 110.756 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.99 169.48 6.73 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.213 1.005 . . . . 0.0 111.536 170.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.96 -54.8 32.79 Favored 'General case' 0 C--O 1.231 0.124 0 O-C-N 121.632 -0.668 . . . . 0.0 110.451 175.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -10.53 52.56 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -176.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -75.99 -17.33 59.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.102 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.7 -88.34 0.2 Allowed Glycine 0 C--N 1.337 0.636 0 CA-C-N 119.306 0.957 . . . . 0.0 110.73 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.96 86.12 19.1 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.324 2.25 . . . . 0.0 109.129 -170.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -71.66 175.31 9.74 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.811 2.341 . . . . 0.0 112.079 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.85 110.38 22.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 127.915 2.486 . . . . 0.0 109.276 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 p -114.91 117.59 31.08 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.74 1.616 . . . . 0.0 109.072 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -81.99 165.33 20.78 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.697 HG23 ' OG ' ' A' ' 27' ' ' SER . 3.6 m -145.55 134.78 22.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 163.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -119.99 97.87 5.81 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 174.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.3 t -150.66 159.36 44.56 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -176.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -108.46 59.56 0.61 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.896 0.771 . . . . 0.0 109.924 -173.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -32.79 69.53 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.129 -0.357 . . . . 0.0 111.092 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.4 p -90.53 10.18 26.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 111.516 177.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.87 -14.24 0.41 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 125.649 1.595 . . . . 0.0 113.596 -164.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.407 HE22 ' CB ' ' A' ' 77' ' ' SER . 1.2 tm0? -96.39 157.69 15.78 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 177.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.6 ptp85 -68.29 72.67 0.2 Allowed 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 126.17 1.788 . . . . 0.0 111.75 175.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.95 132.64 34.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.928 1.291 . . . . 0.0 110.854 176.051 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.7 118.04 36.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.14 154.89 50.15 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 168.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.33 169.68 42.56 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -175.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -96.96 125.49 41.42 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.509 ' HB2' ' CE2' ' A' ' 108' ' ' TYR . 28.3 t -109.27 91.1 3.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.949 0.795 . . . . 0.0 109.218 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 84.18 -64.84 4.2 Favored Glycine 0 C--N 1.332 0.355 0 CA-C-O 118.613 -1.104 . . . . 0.0 110.994 151.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -134.41 -1.07 2.89 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.647 1.224 . . . . 0.0 111.854 163.508 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -144.73 118.86 9.45 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.532 1.133 . . . . 0.0 108.493 -163.404 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.44 160.86 27.5 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.762 -1.211 . . . . 0.0 113.325 173.479 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -133.35 170.38 15.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.567 2.747 . . . . 0.0 112.061 -176.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -153.59 166.78 31.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.612 1.565 . . . . 0.0 111.597 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.69 -163.84 30.52 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.661 1.601 . . . . 0.0 110.25 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.407 ' CB ' HE22 ' A' ' 62' ' ' GLN . 10.4 m -127.71 155.26 44.26 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.373 1.469 . . . . 0.0 109.824 -164.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TYR . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 52.3 p90 -138.97 179.47 6.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -174.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.82 148.2 30.65 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.297 1.839 . . . . 0.0 109.578 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 mp -117.31 103.78 10.49 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.248 2.219 . . . . 0.0 107.089 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.39 -175.08 5.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.549 168.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 53.42 16.19 0.84 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 165.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.81 14.26 58.03 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.051 -1.656 . . . . 0.0 114.285 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.4 pttt -132.72 160.73 35.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.716 1.758 . . . . 0.0 111.26 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.515 ' O ' HG21 ' A' ' 115' ' ' ILE . 17.1 tp -107.51 102.83 12.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 p -97.75 132.55 43.27 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.501 0.721 . . . . 0.0 109.077 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -96.19 -176.76 3.76 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.868 1.267 . . . . 0.0 109.944 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.67 -153.79 8.91 Favored Glycine 0 CA--C 1.521 0.45 0 C-N-CA 125.624 1.583 . . . . 0.0 111.062 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -64.27 85.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 123.228 1.489 . . . . 0.0 107.747 166.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 mt -78.34 178.31 7.77 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 119.923 -1.736 . . . . 0.0 108.52 169.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.97 -171.88 27.58 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 125.889 1.709 . . . . 0.0 109.41 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -179.43 -124.91 0.91 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 119.973 -1.108 . . . . 0.0 114.48 -171.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.1 p -102.59 169.67 8.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.346 1.058 . . . . 0.0 110.277 -165.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . 0.307 0.0 OUTLIER -128.05 40.91 3.59 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.294 1.038 . . . . 0.0 110.389 -174.914 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.0 mtt -58.8 140.9 54.44 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -91.14 124.89 35.7 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 91.3 m -136.99 169.09 18.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.121 1.368 . . . . 0.0 109.266 176.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.2 mtp -127.1 23.92 6.44 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.462 0.705 . . . . 0.0 110.26 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 43.8 p -101.89 158.75 31.17 Favored Pre-proline 0 C--O 1.238 0.481 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -168.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.22 -12.09 23.17 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.027 1.152 . . . . 0.0 112.159 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -92.61 -0.34 69.65 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 117.776 -1.569 . . . . 0.0 113.558 171.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.72 -45.67 4.19 Favored Glycine 0 CA--C 1.524 0.649 0 CA-C-N 120.239 2.019 . . . . 0.0 112.13 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -73.34 -22.5 60.29 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.812 1.306 . . . . 0.0 111.746 -174.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.7 tt -63.13 -14.33 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 O-C-N 121.503 -0.748 . . . . 0.0 112.352 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.514 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 5.3 tm-20 -66.56 -4.02 7.62 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.759 173.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.95 -64.17 1.9 Allowed Glycine 0 CA--C 1.533 1.214 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 164.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -33.29 74.47 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.287 -1.125 . . . . 0.0 112.626 -169.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.685 ' CE1' HD13 ' A' ' 109' ' ' LEU . 0.4 OUTLIER -63.6 -36.59 84.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.503 0.721 . . . . 0.0 110.428 -171.398 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.685 HD13 ' CE1' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -75.43 -23.21 56.93 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.694 1.198 . . . . 0.0 111.117 176.65 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.18 -24.17 40.51 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 171.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.95 -39.74 61.17 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 123.218 0.607 . . . . 0.0 109.493 173.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.3 -14.51 27.32 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 56.8 p -82.35 -4.31 57.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.671 1.578 . . . . 0.0 112.494 175.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -118.2 84.07 2.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.229 1.412 . . . . 0.0 109.252 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.515 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.5 mm -128.37 60.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.29 -29.48 66.24 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.556 1.169 . . . . 0.0 110.048 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.542 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -141.03 158.29 44.14 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.03 1.395 . . . . 0.0 112.781 -178.507 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 130' ' ' LEU . 21.0 m -151.41 171.98 16.66 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 125.336 1.454 . . . . 0.0 108.495 174.245 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.64 99.33 0.18 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 108.528 -1.829 . . . . 0.0 108.528 172.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.7 p -100.61 136.24 33.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 O-C-N 121.263 -1.139 . . . . 0.0 108.987 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -107.8 76.65 1.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.574 ' CG ' ' HB1' ' A' ' 19' ' ' ALA . 79.0 mmm -71.74 50.92 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.707 -1.245 . . . . 0.0 111.824 175.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.5 tpp85 -134.99 129.12 33.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.19 130.03 94.26 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 117.647 -1.168 . . . . 0.0 109.849 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.89 119.45 6.16 Favored 'Cis proline' 0 CA--C 1.54 0.81 0 CA-C-N 119.7 0.928 . . . . 0.0 112.824 3.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -84.76 131.78 34.52 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.92 1.288 . . . . 0.0 109.691 -168.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -141.85 167.96 20.89 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 125.803 1.641 . . . . 0.0 108.95 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 7.5 tmm? -122.75 134.99 54.43 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -119.1 144.44 46.6 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 162.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.87 ' H ' HD12 ' A' ' 130' ' ' LEU 0.305 0.1 OUTLIER -112.64 167.71 10.25 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.03 0.932 . . . . 0.0 109.072 160.491 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.542 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 59.4 t -124.0 147.87 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 157.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.11 161.03 15.27 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 172.18 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.21 -25.05 30.54 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.334 0.97 . . . . 0.0 111.526 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -82.43 -19.35 39.18 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 125.263 1.425 . . . . 0.0 112.009 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 113.94 -9.51 23.21 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.591 1.567 . . . . 0.0 114.484 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 148.19 23.97 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.64 1.72 . . . . 0.0 109.421 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.06 99.02 3.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.978 0.911 . . . . 0.0 108.682 -168.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 130' ' ' LEU . 6.4 mp -86.75 142.7 27.95 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 119.733 -1.855 . . . . 0.0 108.504 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 90.1 m -109.22 125.22 52.01 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.755 1.622 . . . . 0.0 107.822 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.431 ' CE2' HD13 ' A' ' 30' ' ' LEU . 57.4 m-85 -119.17 151.34 38.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 124.048 0.939 . . . . 0.0 110.453 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -99.32 147.83 24.79 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.937 1.695 . . . . 0.0 108.824 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -76.06 111.49 11.51 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 6.5 t -111.43 93.95 4.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 168.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 9.4 t -117.4 26.37 9.79 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.012 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.297 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -62.04 173.38 3.18 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.643 1.562 . . . . 0.0 110.722 170.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.53 174.92 8.31 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 163.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 59.3 m170 -64.83 165.11 16.66 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 153.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.05 71.14 3.58 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 122.364 2.043 . . . . 0.0 110.682 170.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -143.57 89.98 2.12 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 128.58 2.752 . . . . 0.0 104.428 168.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.87 176.69 2.15 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.662 1.585 . . . . 0.0 108.226 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 64.54 19.37 11.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.873 2.069 . . . . 0.0 116.473 152.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.16 46.47 2.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.315 1.046 . . . . 0.0 110.197 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.0 t -136.54 134.3 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.7 151.57 92.06 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 123.827 0.851 . . . . 0.0 110.83 177.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.78 126.83 10.37 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.675 2.25 . . . . 0.0 111.645 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -81.67 144.82 53.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 125.381 1.472 . . . . 0.0 108.958 174.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -71.04 177.88 5.98 Favored 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 123.711 2.94 . . . . 0.0 112.583 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 51.85 47.19 25.26 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.825 1.65 . . . . 0.0 110.677 -175.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -70.99 143.68 89.22 Favored Pre-proline 0 N--CA 1.454 -0.256 0 CA-C-O 117.681 -1.152 . . . . 0.0 108.883 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -78.69 -16.75 12.89 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.959 2.439 . . . . 0.0 112.073 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.91 39.93 0.14 Allowed 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 122.751 1.262 . . . . 0.0 111.602 174.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 122' ' ' MET . . . -139.43 -46.22 0.46 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 130.065 3.346 . . . . 0.0 106.4 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.481 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -60.83 -20.69 62.16 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.593 1.157 . . . . 0.0 112.843 -176.123 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.3 -12.0 54.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 114.773 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 7.18 46.61 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.565 1.546 . . . . 0.0 110.589 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 20' ' ' THR . 2.7 mm? -82.15 56.32 3.14 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.381 -1.449 . . . . 0.0 109.312 -176.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -135.57 -40.22 0.71 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.623 -0.703 . . . . 0.0 112.296 -161.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.1 39.43 3.67 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 172.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 p -120.92 157.74 29.2 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.506 -1.371 . . . . 0.0 110.975 -174.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -127.6 152.47 47.6 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 123.99 0.916 . . . . 0.0 109.106 -178.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -149.59 162.5 40.07 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 113.257 -1.792 . . . . 0.0 108.604 -166.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.7 t -147.58 136.04 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 140' ' ' PHE . 17.2 tp -82.25 150.65 27.19 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 119.276 0.944 . . . . 0.0 110.311 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 t -134.31 -27.32 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 175.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -151.79 157.97 42.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.309 1.413 . . . . 0.0 110.389 177.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.745 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.2 t90 -143.35 106.6 4.55 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.082 2.153 . . . . 0.0 108.469 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.07 131.61 34.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 172.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -61.53 161.61 9.38 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 159.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -44.32 -42.95 7.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.158 1.783 . . . . 0.0 112.654 165.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.23 -14.23 62.17 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.683 1.593 . . . . 0.0 111.987 -173.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.55 1.72 58.93 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.948 1.737 . . . . 0.0 112.64 -175.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.1 m -69.4 108.89 3.92 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.073 1.749 . . . . 0.0 109.794 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.39 140.36 48.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.153 -0.967 . . . . 0.0 110.64 170.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -97.05 166.47 11.58 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.436 1.494 . . . . 0.0 111.606 -175.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.5 102.99 13.96 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 173.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 28.0 m -114.43 148.89 41.21 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 173.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.7 102.69 1.64 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.137 2.558 . . . . 0.0 110.203 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.08 169.31 0.4 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 126.162 1.785 . . . . 0.0 114.442 168.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.87 -37.38 71.26 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.046 0.938 . . . . 0.0 112.873 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -80.86 -15.2 57.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -73.85 -22.92 59.59 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 121.589 -0.694 . . . . 0.0 111.515 -172.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.56 -32.14 2.34 Favored Glycine 0 C--N 1.337 0.604 0 N-CA-C 115.335 0.894 . . . . 0.0 115.335 156.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.17 85.26 8.2 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 172.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 162.28 39.82 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.035 1.823 . . . . 0.0 111.22 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.7 mt -77.99 106.85 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 124.537 1.135 . . . . 0.0 109.093 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -99.41 159.02 15.32 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.377 0.671 . . . . 0.0 109.629 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -140.16 141.97 36.0 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.402 2.281 . . . . 0.0 106.465 165.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.2 m -134.37 145.84 49.35 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 120.833 -1.167 . . . . 0.0 108.146 159.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.4 mt -118.4 117.32 28.74 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 103.71 -2.7 . . . . 0.0 103.71 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -163.54 178.7 7.79 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 171.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.0 p -116.92 16.46 15.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -161.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -51.72 -32.68 31.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.1 p -65.97 -21.82 66.44 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 121.336 1.88 . . . . 0.0 111.875 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.92 -0.03 60.47 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.897 1.713 . . . . 0.0 111.01 -160.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -131.27 167.8 18.6 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.106 1.453 . . . . 0.0 109.771 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -71.51 80.38 0.79 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.732 2.013 . . . . 0.0 106.742 173.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -106.07 112.79 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.518 1.527 . . . . 0.0 109.083 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.54 149.88 45.32 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 168.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -145.65 152.42 39.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 167.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 176.71 -168.74 40.9 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 6.0 t80 -131.55 128.73 39.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 103.34 -2.837 . . . . 0.0 103.34 172.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.4 m -119.59 11.19 11.97 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.443 1.02 . . . . 0.0 113.594 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 169.25 -63.09 0.18 Allowed Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.295 -1.281 . . . . 0.0 112.122 168.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 9.2 t -166.96 9.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.632 1.716 . . . . 0.0 113.713 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 27.7 m-20 -112.06 -7.66 14.08 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 118.813 -2.429 . . . . 0.0 112.92 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' HA ' ' HA ' ' A' ' 68' ' ' PHE 0.321 0.0 OUTLIER 44.21 179.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 127.615 2.366 . . . . 0.0 113.07 -164.246 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 10.2 p90 -160.25 166.77 28.94 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.645 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -157.37 168.3 27.77 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.957 2.503 . . . . 0.0 106.392 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 143.9 175.88 17.42 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.431 1.015 . . . . 0.0 110.876 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.4 m -79.54 164.43 23.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -166.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -142.55 176.84 8.72 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.642 1.177 . . . . 0.0 111.541 170.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -158.3 159.23 35.71 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.147 1.379 . . . . 0.0 110.283 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.87 128.62 50.6 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 125.385 1.474 . . . . 0.0 108.817 -177.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt 176.18 171.58 0.4 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 128.111 2.564 . . . . 0.0 107.175 -171.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t0 58.3 24.13 11.21 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 158.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.01 5.78 59.0 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 118.251 -1.305 . . . . 0.0 113.998 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.435 ' HA ' HG21 ' A' ' 20' ' ' THR . 14.5 pttt -131.31 168.41 17.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.806 1.803 . . . . 0.0 112.122 -171.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.5 tp -101.89 109.65 21.44 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 163.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -90.7 159.48 16.34 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -120.1 178.88 4.46 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.497 1.119 . . . . 0.0 110.126 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -101.87 -112.11 3.55 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 175.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 t -143.86 67.16 1.28 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 128.242 2.617 . . . . 0.0 105.284 -162.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.716 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -68.26 163.74 22.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.159 0.984 . . . . 0.0 111.031 -171.618 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.89 172.83 45.81 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 166.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.34 -134.46 2.8 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.2 p -103.22 -167.96 1.45 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.75 1.62 . . . . 0.0 109.774 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -128.24 67.47 1.36 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.045 1.738 . . . . 0.0 109.481 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.7 mtm -101.14 157.26 16.9 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.603 -0.685 . . . . 0.0 109.165 -176.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.27 118.72 32.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.038 0.935 . . . . 0.0 108.643 -171.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -102.37 -22.87 14.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 177.967 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.256 23.2 ptp 49.49 31.36 3.98 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -169.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 61.1 p -122.64 160.71 47.47 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.502 1.521 . . . . 0.0 107.47 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.8 -41.67 7.7 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.727 1.618 . . . . 0.0 111.632 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.93 -30.96 76.8 Favored Glycine 0 C--N 1.34 0.762 0 CA-C-O 118.699 -1.056 . . . . 0.0 111.005 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -68.98 -17.04 71.26 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.899 1.85 . . . . 0.0 113.242 173.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -98.91 -12.12 21.02 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.577 1.189 . . . . 0.0 112.385 -173.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.7 tt -81.95 -16.13 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -174.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -58.22 -37.65 75.26 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.911 0.778 . . . . 0.0 110.545 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.53 73.71 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-O 118.628 -1.095 . . . . 0.0 113.464 176.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.7 59.75 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 120.097 1.949 . . . . 0.0 110.158 173.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -71.52 -44.22 65.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.5 1.12 . . . . 0.0 110.668 -174.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.81 -28.17 68.59 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.566 -1.334 . . . . 0.0 111.272 172.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.56 -20.57 50.3 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 174.184 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.2 -37.61 25.8 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.457 1.503 . . . . 0.0 109.927 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -13.77 0.55 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.676 2.391 . . . . 0.0 114.584 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.3 p -114.96 -0.32 13.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.697 1.599 . . . . 0.0 113.09 -176.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -110.51 35.38 3.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.629 1.104 . . . . 0.0 109.973 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.3 mm -71.65 74.4 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.839 1.256 . . . . 0.0 108.017 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.87 -25.77 27.79 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.392 -0.817 . . . . 0.0 109.987 173.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -137.37 164.97 27.33 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 122.445 1.117 . . . . 0.0 112.609 174.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.4 m -158.6 162.91 37.36 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 127.577 2.351 . . . . 0.0 107.126 -176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.02 91.81 0.1 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 108.791 -1.724 . . . . 0.0 108.791 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 128' ' ' MET . 2.2 p -77.53 145.75 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 120.229 -1.748 . . . . 0.0 109.242 166.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -120.31 98.54 6.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.453 1.901 . . . . 0.0 107.401 174.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.424 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 12.2 mtp -88.42 1.79 54.01 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 177.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -61.81 132.08 51.96 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 157.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 140.73 98.16 Favored Pre-proline 0 N--CA 1.442 -0.852 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 170.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.42 118.68 4.71 Favored 'Cis proline' 0 N--CA 1.454 -0.8 0 CA-C-N 119.861 0.986 . . . . 0.0 110.558 -1.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -68.46 127.32 32.57 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.742 0.782 . . . . 0.0 109.213 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -140.41 161.49 37.57 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.286 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' MET . . . . . 0.402 ' HA ' ' HA ' ' A' ' 120' ' ' VAL . 40.2 ttp -115.39 148.87 38.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -130.21 133.61 46.68 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 176.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 52.7 mt -119.11 154.01 33.9 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.9 t -142.26 126.63 16.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.7 mt -84.45 170.91 13.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.452 . . . . 0.0 111.224 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -63.05 -2.17 1.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.56 1.944 . . . . 0.0 114.543 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -109.39 -10.29 14.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.89 1.676 . . . . 0.0 112.163 172.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.79 18.57 15.34 Favored Glycine 0 C--N 1.334 0.445 0 O-C-N 120.896 -1.128 . . . . 0.0 114.249 169.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.97 167.87 3.56 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.311 1.044 . . . . 0.0 110.982 174.973 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -139.66 104.15 4.85 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.348 -0.845 . . . . 0.0 109.059 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.745 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.6 OUTLIER -92.57 160.74 14.89 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.907 -1.12 . . . . 0.0 110.973 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 139' ' ' THR . . . . . 0.401 ' O ' HD12 ' A' ' 30' ' ' LEU . 2.6 m -134.85 110.7 9.34 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 122.572 0.349 . . . . 0.0 111.201 -174.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 77.7 m-85 -114.06 140.98 48.02 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 123.972 0.795 . . . . 0.0 110.387 173.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -85.97 147.27 26.3 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 163.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -64.51 137.07 57.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 160.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 36.5 t -123.91 104.58 9.01 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 120.197 1.362 . . . . 0.0 107.99 163.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.3 t -123.12 17.59 9.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 123.489 0.493 . . . . 0.0 111.316 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? . . . . . 0 C--O 1.251 1.172 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 154.499 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 120.358 0.123 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.39 151.66 59.89 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.707 2.271 . . . . 0.0 110.401 172.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.84 136.38 28.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 169.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -87.81 167.61 19.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.381 1.873 . . . . 0.0 110.611 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -76.48 -5.28 15.97 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.853 2.369 . . . . 0.0 113.937 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 59.17 21.02 9.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.064 1.745 . . . . 0.0 112.656 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.0 m -73.64 105.34 4.92 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.564 1.146 . . . . 0.0 110.42 -175.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -162.64 108.15 1.18 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 128.592 2.757 . . . . 0.0 107.548 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 76.28 62.79 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 128.731 2.812 . . . . 0.0 110.323 170.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.77 155.11 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 C-N-CA 125.391 1.477 . . . . 0.0 109.558 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.16 156.86 66.37 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 126.398 1.879 . . . . 0.0 110.981 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -72.01 152.0 56.66 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.313 2.008 . . . . 0.0 110.459 176.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.85 159.63 81.53 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 125.103 1.361 . . . . 0.0 110.594 174.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -72.54 -167.87 0.36 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 124.065 3.177 . . . . 0.0 111.307 171.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 75.07 171.45 0.28 Allowed 'General case' 0 C--O 1.235 0.307 0 C-N-CA 128.115 2.566 . . . . 0.0 110.704 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -159.25 144.13 11.51 Favored Pre-proline 0 N--CA 1.468 0.47 0 O-C-N 121.301 -0.875 . . . . 0.0 111.583 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.79 -18.98 18.86 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.317 2.012 . . . . 0.0 111.942 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -13.32 23.62 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 119.23 0.923 . . . . 0.0 112.388 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.68 -25.64 49.68 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 119.726 1.148 . . . . 0.0 112.702 172.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -63.33 -31.02 72.07 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.822 0.849 . . . . 0.0 112.389 -160.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -21.8 66.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.753 0.706 . . . . 0.0 112.23 -175.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.0 mt -83.84 -9.43 58.77 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.449 1.1 . . . . 0.0 111.465 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.95 -13.52 62.49 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.813 0.845 . . . . 0.0 112.098 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -60.46 -9.82 4.15 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.801 2.04 . . . . 0.0 112.87 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -128.58 10.0 6.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.595 1.958 . . . . 0.0 111.483 -165.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.8 p -113.69 -174.76 2.53 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.463 -162.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -153.01 -66.58 0.16 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 118.211 -0.9 . . . . 0.0 112.186 -171.121 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.4 m95 65.88 171.29 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.91 1.284 . . . . 0.0 113.769 176.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.7 t -139.12 135.84 42.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 172.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.2 tp -74.44 143.24 44.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.83 -21.34 0.72 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 175.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -142.49 166.89 23.44 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 120.632 1.56 . . . . 0.0 111.388 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' ' CE1' ' A' ' 108' ' ' TYR . 5.9 t90 -150.65 101.48 2.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.06 2.144 . . . . 0.0 107.492 -176.02 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.6 145.11 25.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 170.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -88.44 172.31 9.46 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.386 0.674 . . . . 0.0 109.542 162.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.91 -34.48 73.25 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.273 1.029 . . . . 0.0 112.836 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.55 5.41 20.93 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.047 0.451 . . . . 0.0 110.823 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.61 11.66 60.41 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.221 1.391 . . . . 0.0 111.439 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 m -74.19 99.32 3.37 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 120.85 -1.383 . . . . 0.0 108.398 -174.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.5 104.36 1.24 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.158 0.98 . . . . 0.0 108.878 168.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 -59.4 157.5 11.01 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.78 1.232 . . . . 0.0 110.118 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.74 124.36 27.15 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.17 150.19 75.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.78 104.44 1.91 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.951 2.434 . . . . 0.0 110.179 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 169.26 11.24 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.006 1.322 . . . . 0.0 108.565 173.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.93 -46.43 71.53 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.786 -0.571 . . . . 0.0 111.618 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.34 -10.4 58.91 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.285 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -76.33 -12.04 60.0 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.851 0.86 . . . . 0.0 112.152 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.15 -32.97 4.54 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 124.337 0.97 . . . . 0.0 112.723 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.14 85.85 13.53 Favored Pre-proline 0 N--CA 1.449 -0.486 0 C-N-CA 125.993 1.717 . . . . 0.0 109.268 -171.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.3 132.8 32.69 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.76 1.64 . . . . 0.0 108.676 168.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.3 mt -69.99 98.95 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 O-C-N 121.913 -0.492 . . . . 0.0 109.821 173.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.9 p -75.9 154.0 36.32 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 171.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.67 155.04 39.85 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 172.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 17.6 m -141.9 137.4 31.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 85' ' ' LEU . 87.1 mt -128.99 60.4 1.55 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.272 1.429 . . . . 0.0 107.947 174.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.8 t -134.78 172.32 13.13 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.629 1.172 . . . . 0.0 108.238 -171.421 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -95.52 44.2 1.09 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.282 -1.511 . . . . 0.0 111.408 -160.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -13.38 6.04 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 p -121.18 0.03 10.04 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.158 2.183 . . . . 0.0 112.411 170.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.17 -39.79 2.66 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 127.991 2.71 . . . . 0.0 111.897 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -82.97 172.88 12.31 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.05 0.94 . . . . 0.0 108.691 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -75.87 76.47 2.79 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.956 0.884 . . . . 0.0 110.484 171.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -102.98 123.82 47.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.946 1.698 . . . . 0.0 106.992 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.96 144.49 31.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.872 1.669 . . . . 0.0 107.138 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.25 173.54 11.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 164.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.03 -168.72 38.57 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -135.02 95.19 3.26 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.0 m -73.66 77.37 1.52 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.054 1.341 . . . . 0.0 110.868 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.07 -63.57 1.65 Allowed Glycine 0 C--N 1.333 0.373 0 C-N-CA 125.003 1.287 . . . . 0.0 113.857 158.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.7 m -114.22 -16.95 11.97 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 119.509 1.655 . . . . 0.0 111.219 170.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.71 124.56 18.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 -157.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -73.9 162.66 28.85 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.822 1.296 . . . . 0.0 111.41 163.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -145.7 146.8 31.41 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 130.8 3.64 . . . . 0.0 107.049 -175.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 35.0 mtm -147.29 152.24 37.95 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.5 2.32 . . . . 0.0 106.404 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.23 175.22 34.86 Favored Glycine 0 C--N 1.32 -0.356 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.6 m -78.92 155.03 29.19 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.817 0.808 . . . . 0.0 111.168 -175.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 49.1 p90 -125.69 177.14 6.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.714 1.205 . . . . 0.0 110.558 167.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.4 153.49 34.81 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.099 1.76 . . . . 0.0 109.484 174.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.49 101.3 9.74 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 126.884 2.073 . . . . 0.0 105.666 178.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -154.8 158.88 40.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.487 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.0 t0 44.59 33.42 0.92 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.138 1.375 . . . . 0.0 114.692 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . 0.41 ' O ' HG21 ' A' ' 118' ' ' THR . . . 65.39 5.14 20.56 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 118.171 -1.349 . . . . 0.0 114.808 -175.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -123.51 145.64 48.7 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 120.099 1.95 . . . . 0.0 110.986 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -71.82 119.9 16.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 169.929 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -123.98 152.44 42.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 119.037 0.835 . . . . 0.0 109.536 177.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.541 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.9 m-85 -119.59 175.15 5.99 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -172.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.16 -112.48 3.71 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 125.322 1.439 . . . . 0.0 110.458 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -132.08 70.9 1.46 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 127.996 2.519 . . . . 0.0 105.44 -163.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.751 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -71.57 151.77 43.52 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.26 -172.286 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.14 162.99 21.3 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 107.315 -2.314 . . . . 0.0 107.315 172.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.17 -27.19 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.42 0 C-N-CA 119.602 -1.285 . . . . 0.0 113.698 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.5 p -163.85 170.01 17.42 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.346 2.658 . . . . 0.0 109.272 -167.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -128.85 29.35 5.24 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.793 1.637 . . . . 0.0 110.334 -175.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.6 mtt -60.38 141.28 56.52 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 111.137 -168.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -105.57 124.68 49.95 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.227 1.411 . . . . 0.0 108.49 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 59.2 m -127.01 167.85 15.35 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.001 0.92 . . . . 0.0 109.893 168.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 mtp -120.56 47.01 1.87 Allowed 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 -177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.9 p -132.83 156.98 79.48 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.97 1.708 . . . . 0.0 108.128 177.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -60.24 -47.95 13.24 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.967 2.444 . . . . 0.0 110.819 174.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.24 -11.37 58.93 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.922 -0.932 . . . . 0.0 112.115 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.85 -60.22 2.48 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 119.148 1.474 . . . . 0.0 111.521 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -75.95 -18.07 59.48 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.528 1.164 . . . . 0.0 113.939 -168.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.6 tt -60.97 -21.03 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.155 0.982 . . . . 0.0 112.467 176.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -45.77 -46.11 15.06 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.149 1.78 . . . . 0.0 110.52 174.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -66.08 -34.96 89.83 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.77 -1.206 . . . . 0.0 113.042 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.15 75.46 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.691 1.746 . . . . 0.0 110.358 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' TYR . . . . . 0.476 ' CE1' ' CZ3' ' A' ' 33' ' ' TRP . 10.1 m-85 -60.31 -62.09 2.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.079 1.352 . . . . 0.0 109.782 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.86 -23.29 63.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.426 -173.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -61.78 -59.21 5.5 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 123.012 0.525 . . . . 0.0 110.199 168.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.56 -29.82 70.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.907 1.283 . . . . 0.0 110.902 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tp -56.59 -21.21 25.23 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.935 1.294 . . . . 0.0 112.992 -175.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -85.96 -23.19 27.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.423 1.465 . . . . 0.0 112.223 177.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -94.42 37.95 1.11 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.475 1.51 . . . . 0.0 111.338 -166.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.7 mm -75.96 79.92 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 174.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -79.69 -30.31 41.06 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.433 -0.792 . . . . 0.0 109.982 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.401 ' HE ' HG12 ' A' ' 131' ' ' VAL . 20.5 mtm180 -132.98 173.62 11.21 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 127.549 2.34 . . . . 0.0 109.434 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.41 HG21 ' O ' ' A' ' 83' ' ' GLY . 4.8 t -159.23 -179.49 8.03 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -172.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.48 84.57 0.08 OUTLIER Glycine 0 CA--C 1.53 0.978 0 C-N-CA 123.691 0.663 . . . . 0.0 112.046 171.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.293 1.7 p -88.88 120.96 38.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 119.101 1.45 . . . . 0.0 109.863 171.515 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 41.7 tt0 -90.09 96.52 10.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 175.085 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 43.6 tpp -87.71 60.29 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.582 1.182 . . . . 0.0 108.181 177.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -153.38 135.95 15.16 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 171.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.31 92.89 Favored Pre-proline 0 N--CA 1.443 -0.822 0 CA-C-N 118.568 0.622 . . . . 0.0 110.212 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.5 119.05 3.65 Favored 'Cis proline' 0 N--CA 1.459 -0.536 0 CA-C-N 119.336 0.799 . . . . 0.0 110.262 -8.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -72.5 127.31 32.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 122.208 1.004 . . . . 0.0 108.514 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -142.77 159.68 41.77 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 126.209 1.804 . . . . 0.0 106.527 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.7 ttp -142.17 104.61 4.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -165.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -69.78 144.49 52.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 161.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.75 152.12 33.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 149.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.401 HG12 ' HE ' ' A' ' 117' ' ' ARG . 64.6 t -135.38 120.2 27.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.46 165.75 21.9 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.055 1.407 . . . . 0.0 111.079 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -53.94 -36.94 63.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.98 2.112 . . . . 0.0 111.273 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -81.82 -11.4 58.98 Favored 'General case' 0 C--O 1.226 -0.166 0 O-C-N 120.915 -1.116 . . . . 0.0 110.431 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.05 12.11 30.43 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 123.981 0.801 . . . . 0.0 113.902 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.18 166.19 5.08 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.172 1.486 . . . . 0.0 110.57 174.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.1 m -151.09 99.5 2.69 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 120.405 -1.434 . . . . 0.0 109.956 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -78.05 166.45 22.8 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 121.119 -0.988 . . . . 0.0 109.769 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 18.3 m -132.47 120.91 22.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -119.53 156.6 29.98 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.844 0.715 . . . . 0.0 110.09 168.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 131.09 53.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 126.863 2.065 . . . . 0.0 108.514 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.24 110.55 2.62 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.341 1.457 . . . . 0.0 110.427 -176.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.91 73.69 1.51 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 170.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.3 m -88.54 37.45 0.83 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 168.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.156 0 O-C-N 119.97 -1.706 . . . . 0.0 111.042 -172.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 9.4 pt . . . . . 0 CA--C 1.539 0.555 0 CA-C-O 119.665 -0.207 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.36 63.71 8.79 Favored 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 122.294 1.996 . . . . 0.0 111.069 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp 62.49 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.755 2.022 . . . . 0.0 109.239 -168.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.48 160.48 7.24 Favored Pre-proline 0 CA--C 1.534 0.357 0 C-N-CA 123.407 0.683 . . . . 0.0 111.449 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.07 -7.17 20.82 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.123 1.882 . . . . 0.0 113.044 173.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 t70 74.42 163.01 0.26 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.042 2.537 . . . . 0.0 112.15 174.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.4 m 59.94 11.2 2.48 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.003 2.521 . . . . 0.0 114.878 173.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -89.76 58.24 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.398 1.879 . . . . 0.0 110.39 -170.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.62 80.46 2.0 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 122.518 1.151 . . . . 0.0 109.863 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 56.28 51.53 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 127.572 2.349 . . . . 0.0 110.45 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.81 144.79 98.97 Favored Pre-proline 0 C--O 1.238 0.449 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.667 172.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.87 151.4 50.92 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.932 2.421 . . . . 0.0 109.622 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -93.82 144.76 28.67 Favored Pre-proline 0 C--O 1.24 0.569 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.04 -176.97 0.69 Allowed 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.307 2.671 . . . . 0.0 110.537 164.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 65.48 167.2 0.19 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 126.56 1.944 . . . . 0.0 112.698 177.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -142.03 143.31 27.65 Favored Pre-proline 0 N--CA 1.457 -0.106 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.734 -173.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.24 -35.79 2.78 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.493 2.128 . . . . 0.0 111.212 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.48 72.96 1.01 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.523 1.929 . . . . 0.0 108.94 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.672 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -173.51 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 129.672 3.189 . . . . 0.0 108.037 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.5 m -63.31 -22.99 67.22 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.177 -0.952 . . . . 0.0 111.689 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -56.8 -15.99 5.75 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.499 1.12 . . . . 0.0 113.416 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.0 mt -98.42 5.14 48.35 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.683 1.193 . . . . 0.0 111.853 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.409 HD13 ' HE1' ' A' ' 28' ' ' TRP . 0.7 OUTLIER -75.11 75.01 2.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.939 1.696 . . . . 0.0 108.571 178.0 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -143.96 -29.29 0.5 Allowed 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 168.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -111.24 -5.52 14.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.892 1.277 . . . . 0.0 112.665 173.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.4 p -71.26 176.05 4.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.811 1.244 . . . . 0.0 110.814 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.3 OUTLIER -138.3 -64.67 0.52 Allowed 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 120.594 -1.316 . . . . 0.0 110.696 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.409 ' HE1' HD13 ' A' ' 23' ' ' LEU . 4.3 m95 67.77 163.01 0.2 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.974 1.71 . . . . 0.0 112.949 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -140.83 136.41 34.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 48.5 tp -85.26 135.58 33.86 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.92 -12.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 176.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.98 151.51 39.84 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.762 1.619 . . . . 0.0 111.714 172.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -142.17 101.16 3.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.31 1.844 . . . . 0.0 106.813 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.51 140.44 29.53 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.075 -1.016 . . . . 0.0 108.556 170.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.403 ' HA ' ' CG ' ' A' ' 136' ' ' ASP . 18.5 mt-30 -78.67 170.13 17.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.823 0.738 . . . . 0.0 111.542 166.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -21.8 38.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.313 2.245 . . . . 0.0 114.757 -177.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -111.08 1.86 17.59 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.528 1.058 . . . . 0.0 112.049 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 117.36 0.67 18.58 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.054 0.835 . . . . 0.0 113.795 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.2 m -67.62 95.29 0.47 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.156 1.478 . . . . 0.0 110.156 -175.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.35 107.08 1.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 O-C-N 120.16 -1.587 . . . . 0.0 111.091 171.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -65.72 159.9 24.06 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.974 1.709 . . . . 0.0 110.94 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.24 34.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 170.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.9 m -137.52 164.73 39.43 Favored Pre-proline 0 C--O 1.236 0.39 0 C-N-CA 123.824 0.85 . . . . 0.0 109.148 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 112.97 3.6 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 121.947 1.765 . . . . 0.0 110.478 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -64.74 178.09 0.84 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.151 0.981 . . . . 0.0 110.245 162.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.76 99.8 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.396 -0.815 . . . . 0.0 110.241 165.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -32.24 73.8 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.332 1.453 . . . . 0.0 110.91 -174.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -59.5 -12.99 7.28 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.219 1.808 . . . . 0.0 113.479 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -45.16 1.36 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 124.098 0.856 . . . . 0.0 111.563 165.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.88 77.89 75.98 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.447 1.499 . . . . 0.0 109.087 -175.107 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.22 154.72 69.44 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 124.569 3.513 . . . . 0.0 112.138 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.45 100.07 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.051 0.94 . . . . 0.0 108.472 171.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.3 p -92.14 154.78 18.48 Favored 'General case' 0 C--O 1.241 0.647 0 O-C-N 121.816 -0.552 . . . . 0.0 110.068 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -121.28 155.33 34.91 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.068 1.747 . . . . 0.0 106.882 173.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 8.9 m -147.78 99.48 3.1 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.568 -0.707 . . . . 0.0 109.667 176.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.89 125.35 29.14 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.06 -164.34 1.59 Allowed 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 p -139.16 24.15 2.54 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.737 2.815 . . . . 0.0 110.679 -169.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.9 p -68.62 0.44 4.15 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -167.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.0 p -117.5 1.5 12.32 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.962 1.705 . . . . 0.0 110.933 171.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.4 -48.35 0.95 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 127.447 2.451 . . . . 0.0 110.564 -176.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -93.26 170.68 9.44 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.751 1.62 . . . . 0.0 109.157 -169.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -73.55 101.44 3.57 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -124.23 141.95 51.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.12 100.59 10.06 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 126.364 1.866 . . . . 0.0 106.715 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.2 t -108.35 148.43 30.09 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 164.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.38 -162.13 12.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 106.799 -2.52 . . . . 0.0 106.799 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HB3' ' A' ' 73' ' ' ARG . 77.0 t80 -108.37 -11.99 15.11 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -171.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.2 m 51.52 -164.96 0.05 Allowed 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 129.886 3.274 . . . . 0.0 111.601 -172.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.49 -30.23 33.39 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.444 1.497 . . . . 0.0 113.247 172.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.0 t -174.91 0.06 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.486 0.715 . . . . 0.0 112.258 162.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -125.68 102.74 7.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 123.665 1.698 . . . . 0.0 109.575 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HB3' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -55.5 132.44 48.49 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.945 -171.853 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.07 165.14 12.65 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 128.153 2.581 . . . . 0.0 109.446 -164.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.5 mtm -152.45 156.59 39.77 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.512 -2.033 . . . . 0.0 105.512 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.69 175.83 30.06 Favored Glycine 0 C--N 1.318 -0.44 0 C-N-CA 124.607 1.099 . . . . 0.0 110.397 173.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.4 m -87.48 165.24 15.67 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 122.092 -0.652 . . . . 0.0 110.927 -173.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -145.96 178.33 8.27 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -159.07 155.89 28.21 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.073 1.749 . . . . 0.0 109.569 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mp -112.31 127.08 55.89 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 125.512 1.525 . . . . 0.0 107.754 175.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 169.36 15.01 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 124.795 1.238 . . . . 0.0 109.317 171.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.6 t0 44.66 44.88 7.77 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.739 1.616 . . . . 0.0 113.477 168.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.82 0.66 5.39 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 115.585 0.994 . . . . 0.0 115.585 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -127.33 172.2 10.84 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 126.227 1.811 . . . . 0.0 112.013 -166.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.03 103.31 9.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -174.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -90.86 151.51 21.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.47 ' HB3' HD21 ' A' ' 90' ' ' LEU . 82.5 m-85 -118.08 -179.83 3.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 123.485 0.714 . . . . 0.0 110.698 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -107.61 -105.32 3.0 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 176.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 m -140.91 71.62 1.37 Allowed 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 -169.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.626 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -63.33 167.04 5.64 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.528 0.68 . . . . 0.0 111.033 -177.698 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.79 170.95 26.08 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 107.711 -2.155 . . . . 0.0 107.711 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -155.42 -156.08 7.62 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -160.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.4 p -76.88 -179.69 5.61 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 122.255 -0.556 . . . . 0.0 109.622 165.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -133.68 86.98 2.33 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 163.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 10.0 mtt -80.52 154.46 27.51 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.47 140.39 58.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 159.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 98.9 m -142.71 -19.27 0.67 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.481 1.113 . . . . 0.0 113.392 172.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.0 mtm 62.18 25.57 15.31 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.38 1.072 . . . . 0.0 113.739 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -123.81 161.56 45.81 Favored Pre-proline 0 C--O 1.24 0.562 0 C-N-CA 125.909 1.683 . . . . 0.0 110.233 -176.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.27 -33.0 19.42 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.68 2.253 . . . . 0.0 111.231 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -60.14 -33.75 81.07 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.967 0.794 . . . . 0.0 111.524 172.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.92 -43.19 99.65 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 118.076 0.938 . . . . 0.0 112.42 172.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -85.85 -33.25 21.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.138 0.969 . . . . 0.0 112.895 -170.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 17.6 tt -61.01 -18.29 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 118.819 0.736 . . . . 0.0 111.599 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -56.96 -36.21 70.02 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 121.352 -0.842 . . . . 0.0 111.858 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.86 -26.55 60.7 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.282 -0.732 . . . . 0.0 112.414 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.26 -40.17 15.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 118.697 1.249 . . . . 0.0 110.601 173.651 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -30.54 57.07 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 -158.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.1 mt -60.41 -38.94 85.6 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.808 1.243 . . . . 0.0 110.068 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -36.95 67.34 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 122.782 0.433 . . . . 0.0 110.361 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.95 66.09 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 122.083 -0.385 . . . . 0.0 111.288 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.88 -7.32 39.25 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.12 -0.943 . . . . 0.0 113.349 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.7 p -94.77 -11.68 28.54 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 120.789 1.631 . . . . 0.0 112.317 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -113.54 35.31 4.08 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.169 0.987 . . . . 0.0 110.782 -172.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 mm -72.15 72.96 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -75.92 -35.15 59.86 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 169.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -127.54 160.71 30.69 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.138 0.975 . . . . 0.0 110.731 -173.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -151.35 158.11 43.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.604 1.162 . . . . 0.0 107.961 169.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.51 108.37 0.44 Allowed Glycine 0 N--CA 1.441 -1.018 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 172.504 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.4 p -108.5 156.19 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 118.936 1.368 . . . . 0.0 111.174 169.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -136.92 112.07 9.06 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 39.5 ttm -108.45 66.99 0.65 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.514 1.526 . . . . 0.0 109.385 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -152.69 80.6 1.22 Allowed 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.789 1.236 . . . . 0.0 109.458 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -27.88 119.94 0.26 Allowed Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 127.697 2.399 . . . . 0.0 112.437 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.56 122.72 8.81 Favored 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.317 0.792 . . . . 0.0 111.758 15.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -83.28 141.91 31.49 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -172.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -141.53 170.13 16.31 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 161.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -143.22 142.34 31.38 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 127.732 2.413 . . . . 0.0 105.226 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.15 129.08 33.27 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 -174.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 97.1 mt -103.86 140.4 37.72 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.7 t -127.22 123.67 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.94 165.2 25.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -59.66 -33.15 71.18 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.578 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.05 -21.88 39.74 Favored 'General case' 0 C--N 1.341 0.207 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.406 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.15 6.45 12.26 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.37 -1.239 . . . . 0.0 115.407 168.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 35' ' ' GLN . 1.4 m-20 -61.68 133.64 55.83 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.587 2.193 . . . . 0.0 108.72 174.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.4 m -116.33 103.36 10.4 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.845 2.058 . . . . 0.0 108.265 -169.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.8 mp -94.55 114.18 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 51.1 m -86.03 124.31 32.32 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 170.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -99.35 163.4 12.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.484 1.514 . . . . 0.0 108.621 167.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.38 147.64 34.76 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.089 1.756 . . . . 0.0 108.279 163.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.2 tpt85 -81.15 109.41 15.67 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.8 t -91.27 108.52 19.94 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 105.03 -2.211 . . . . 0.0 105.03 163.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.77 16.77 17.33 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.693 2.397 . . . . 0.0 110.69 165.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.188 0 CA-C-O 116.52 -1.705 . . . . 0.0 107.126 164.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.6 pt . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 117.173 -1.394 . . . . 0.0 107.809 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -62.69 157.11 49.05 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 CA-C-N 120.124 1.08 . . . . 0.0 109.333 164.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.06 95.34 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 126.497 1.919 . . . . 0.0 110.48 -170.596 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -65.59 165.33 19.71 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.42 162.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.04 94.26 0.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.39 2.06 . . . . 0.0 108.199 163.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -132.25 166.36 22.06 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 130.888 3.675 . . . . 0.0 106.207 177.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.3 m -144.37 0.54 1.03 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -86.85 42.64 1.03 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.636 1.208 . . . . 0.0 112.494 -167.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.67 50.8 1.96 Allowed 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.878 -1.139 . . . . 0.0 110.528 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 p -148.8 123.61 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -153.94 160.97 30.35 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 123.393 0.677 . . . . 0.0 110.059 170.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.84 124.82 9.48 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.696 2.931 . . . . 0.0 110.319 169.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.82 144.97 45.98 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.373 -173.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -79.76 -164.4 0.28 Allowed 'Trans proline' 0 CA--C 1.542 0.898 1 C-N-CA 125.88 4.387 . . . . 0.0 113.045 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 68.39 71.29 0.3 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.672 2.389 . . . . 0.0 110.505 175.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -94.25 144.63 28.33 Favored Pre-proline 0 C--O 1.232 0.152 0 CA-C-N 115.378 -0.828 . . . . 0.0 113.128 -166.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.1 -28.47 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.669 2.246 . . . . 0.0 111.689 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.78 -21.14 64.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.77 0.828 . . . . 0.0 112.934 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.513 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.96 -16.67 57.98 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.221 -0.925 . . . . 0.0 111.71 176.135 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.536 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.2 t -72.79 -21.01 61.06 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.842 1.201 . . . . 0.0 110.451 -168.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 6.7 pm0 -75.76 3.4 9.9 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 120.01 -1.681 . . . . 0.0 110.743 -177.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -121.56 29.2 7.31 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.095 2.158 . . . . 0.0 109.348 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 120' ' ' VAL . 3.8 mm? -103.09 74.1 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.905 2.082 . . . . 0.0 105.896 167.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.256 2.0 p30 -129.44 -62.54 0.97 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.353 -172.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 2.12 45.2 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.415 1.486 . . . . 0.0 110.804 171.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.99 162.18 29.84 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.698 1.999 . . . . 0.0 109.57 -171.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.1 m -156.08 144.12 19.75 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 118.589 -2.569 . . . . 0.0 107.701 -173.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TRP . . . . . 0.468 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 28.2 m95 -149.02 175.79 11.0 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 124.171 0.92 . . . . 0.0 112.192 -161.05 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.597 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.6 p -153.65 118.63 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 174.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.587 HD11 HD12 ' A' ' 138' ' ' LEU . 7.5 tp -60.41 139.12 57.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.124 -175.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 t -145.63 -2.17 0.76 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 113.274 171.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.43 157.35 42.93 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.036 1.289 . . . . 0.0 110.281 168.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TRP . . . . . 0.551 ' CD1' HD21 ' A' ' 138' ' ' LEU . 2.2 t90 -152.56 100.39 2.55 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 127.098 2.159 . . . . 0.0 105.829 172.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.66 142.84 27.93 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -81.99 170.94 14.99 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 164.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.26 72.36 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 123.574 0.546 . . . . 0.0 111.502 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -86.08 3.13 43.87 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.802 1.641 . . . . 0.0 112.054 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.93 1.14 57.29 Favored Glycine 0 CA--C 1.524 0.605 0 O-C-N 120.746 -1.222 . . . . 0.0 112.789 167.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.4 m -67.01 95.74 0.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 126.344 1.857 . . . . 0.0 109.407 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.77 112.4 2.01 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.958 -1.089 . . . . 0.0 109.759 165.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -71.7 149.6 45.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.378 1.071 . . . . 0.0 109.507 176.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.49 105.73 15.53 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 124.364 1.066 . . . . 0.0 109.164 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.9 m -113.51 152.26 45.19 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 125.872 1.669 . . . . 0.0 107.207 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -73.97 120.08 6.18 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 121.887 1.724 . . . . 0.0 109.034 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.24 171.11 13.61 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.216 0.606 . . . . 0.0 110.119 171.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -38.69 77.28 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 121.895 -0.503 . . . . 0.0 110.459 169.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -9.5 58.66 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -81.57 -29.69 33.31 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.864 0.866 . . . . 0.0 111.803 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.51 -80.01 0.24 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -170.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.07 85.23 58.24 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.163 1.385 . . . . 0.0 110.137 -168.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.47 152.44 75.1 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.187 1.925 . . . . 0.0 111.036 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.1 mt -78.03 101.7 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.9 177.78 6.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.225 1.375 . . . . 0.0 108.5 174.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HG ' ' CE2' ' A' ' 140' ' ' PHE . 1.4 tm? -144.23 146.85 32.92 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 127.031 2.133 . . . . 0.0 106.966 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -145.29 143.52 30.25 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 105.917 -1.882 . . . . 0.0 105.917 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.03 128.96 41.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 172.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -159.8 177.75 10.5 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -129.43 24.03 5.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.121 0.968 . . . . 0.0 112.574 -171.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.79 -31.44 11.67 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.1 p -92.95 8.05 41.42 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.123 177.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.83 -0.46 51.15 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.21 1.386 . . . . 0.0 111.908 -166.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -117.89 161.6 19.49 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 126.037 1.735 . . . . 0.0 108.622 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -75.56 63.47 1.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 124.709 1.203 . . . . 0.0 109.832 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.96 110.64 18.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 120.801 1.637 . . . . 0.0 110.187 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.66 152.5 27.09 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.668 -1.605 . . . . 0.0 107.257 159.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.5 p -141.94 -177.88 5.42 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 125.092 1.357 . . . . 0.0 107.964 161.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.16 168.39 39.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 163.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.461 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 5.7 t80 -89.75 138.35 31.56 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 160.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.5 t -118.71 71.44 0.85 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.01 -36.21 0.4 Allowed Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.975 2.226 . . . . 0.0 116.982 167.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 7.6 t -146.49 -14.26 0.44 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.199 1.399 . . . . 0.0 111.893 163.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -130.06 115.52 17.22 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -64.5 162.46 15.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.519 164.363 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -139.09 168.45 19.81 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 125.341 1.457 . . . . 0.0 109.223 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.8 ptp -152.16 172.81 15.79 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.098 2.159 . . . . 0.0 108.185 170.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.3 -143.62 7.52 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.654 -2.178 . . . . 0.0 107.654 168.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.1 m -125.26 161.23 27.4 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 119.281 1.541 . . . . 0.0 112.777 165.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -128.62 173.62 10.13 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.228 1.011 . . . . 0.0 111.847 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -154.22 139.89 17.98 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.373 1.069 . . . . 0.0 110.349 -176.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.26 120.6 42.27 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 168.45 22.74 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.535 1.534 . . . . 0.0 109.226 169.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t0 48.31 39.06 11.55 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.065 1.346 . . . . 0.0 113.713 167.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.3 13.14 48.32 Favored Glycine 0 CA--C 1.535 1.291 0 O-C-N 120.233 -1.542 . . . . 0.0 114.56 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -134.65 164.8 26.7 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 119.244 1.522 . . . . 0.0 113.01 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.0 tp -109.92 96.83 6.5 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.693 1.597 . . . . 0.0 106.812 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.3 m -87.43 162.3 17.36 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.419 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.3 m-85 -139.3 155.92 47.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.773 1.629 . . . . 0.0 109.166 -176.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.11 -106.6 0.15 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 170.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -143.83 58.84 1.37 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.232 1.015 . . . . 0.0 108.465 -154.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.706 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -60.45 153.11 23.94 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 121.142 -0.974 . . . . 0.0 112.913 -165.805 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.78 173.1 45.42 Favored Glycine 0 N--CA 1.453 -0.201 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -147.54 -117.29 0.97 Allowed Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.3 p -120.82 178.25 4.78 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.689 1.196 . . . . 0.0 110.928 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.6 mtt85 -113.43 73.51 0.82 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.274 1.03 . . . . 0.0 108.68 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtt -74.58 176.99 6.37 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.038 -1.039 . . . . 0.0 109.342 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.43 147.74 52.39 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.55 1.14 . . . . 0.0 109.679 173.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 9.9 m -136.41 -12.62 1.83 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.17 1.788 . . . . 0.0 114.211 177.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 66.03 22.11 11.22 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.856 1.663 . . . . 0.0 113.36 176.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.2 p -110.41 165.3 12.93 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 124.009 0.924 . . . . 0.0 111.191 -165.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.92 -11.46 25.6 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.533 2.155 . . . . 0.0 112.768 164.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -93.05 -9.82 60.37 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-N 118.983 0.811 . . . . 0.0 112.881 168.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.11 -53.44 9.21 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 119.19 1.495 . . . . 0.0 112.487 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -88.2 -16.18 34.0 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -167.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.99 -17.98 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.296 170.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -44.75 -55.18 5.53 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.002 1.321 . . . . 0.0 110.06 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.63 -6.14 70.6 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.002 -0.888 . . . . 0.0 113.742 -173.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -87.08 -51.79 5.8 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.835 1.817 . . . . 0.0 109.005 162.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.84 -47.62 76.91 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.799 1.24 . . . . 0.0 111.416 -171.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.98 -44.39 91.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.059 0.391 . . . . 0.0 110.388 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.44 -34.09 76.1 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.548 0.739 . . . . 0.0 111.624 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.14 59.89 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.95 0.9 . . . . 0.0 112.564 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -72.94 -8.21 54.6 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.475 1.034 . . . . 0.0 112.257 172.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 13.7 p -83.75 -5.07 59.11 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.191 -0.943 . . . . 0.0 111.768 175.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -127.33 83.33 2.16 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.064 2.146 . . . . 0.0 107.283 -169.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -122.18 59.41 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.228 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.41 -22.88 62.68 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.895 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -135.09 165.76 24.62 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.767 1.627 . . . . 0.0 111.095 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 11.2 m -159.93 170.17 21.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.757 1.623 . . . . 0.0 109.019 176.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.06 83.42 0.13 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 125.01 1.29 . . . . 0.0 110.037 168.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 23' ' ' LEU . 2.4 p -81.3 151.48 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.475 1.637 . . . . 0.0 109.898 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -127.0 90.84 3.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.701 1.6 . . . . 0.0 107.603 175.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 35.2 ttm -77.72 73.29 4.29 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.292 1.044 . . . . 0.0 109.25 169.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -151.45 143.42 23.88 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.574 -2.009 . . . . 0.0 105.574 162.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.07 133.44 95.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 119.72 1.145 . . . . 0.0 108.732 173.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -75.49 117.76 4.96 Favored 'Cis proline' 0 N--CA 1.455 -0.781 0 CA-C-N 120.289 1.139 . . . . 0.0 110.923 -2.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -71.21 132.51 45.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -172.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -144.08 163.23 34.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.234 1.014 . . . . 0.0 108.636 173.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.0 ttp -126.44 115.45 19.62 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -86.31 148.7 25.49 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 158.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.47 155.31 45.02 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 126.147 1.779 . . . . 0.0 106.455 167.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.2 t -141.45 125.67 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -174.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.14 165.6 24.67 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.11 -30.77 38.4 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 125.985 1.714 . . . . 0.0 111.843 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.14 -37.77 69.36 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.2 1.0 . . . . 0.0 109.019 -176.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.15 13.56 4.85 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.938 1.256 . . . . 0.0 113.873 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.12 156.36 5.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.174 1.987 . . . . 0.0 110.204 174.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.8 m -126.45 97.62 5.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.0 162.11 19.49 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.257 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 88.2 m -152.94 133.06 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.124 0.57 . . . . 0.0 109.565 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' PHE . . . . . 0.427 ' CE2' ' HG ' ' A' ' 54' ' ' LEU . 2.1 m-85 -126.31 156.01 41.08 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.597 1.559 . . . . 0.0 110.689 -176.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.597 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -91.62 156.85 17.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 117.12 -1.419 . . . . 0.0 107.279 176.19 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -81.82 91.94 6.59 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 122.613 2.461 . . . . 0.0 109.706 163.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 26.6 t -81.72 90.18 6.33 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 166.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 t -91.02 1.83 56.78 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 175.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 129.752 3.221 . . . . 0.0 114.035 -174.261 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 . . . . . 0 C--O 1.236 0.353 0 CA-C-O 121.125 0.488 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -161.52 143.36 8.76 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 124.591 1.156 . . . . 0.0 108.916 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -80.95 -31.83 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.714 2.943 . . . . 0.0 111.844 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.2 56.8 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.349 1.059 . . . . 0.0 110.707 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.574 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -154.56 -41.18 0.09 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 129.69 3.196 . . . . 0.0 107.024 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -68.13 21.45 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.018 1.327 . . . . 0.0 113.766 177.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -120.34 1.48 10.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.668 2.787 . . . . 0.0 111.428 175.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mp -113.2 2.27 15.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 129.199 3.0 . . . . 0.0 109.341 175.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.5 mm? -81.51 67.71 7.57 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.628 1.571 . . . . 0.0 107.891 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.57 -48.52 0.76 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 122.975 0.51 . . . . 0.0 111.032 -173.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.12 65.75 0.92 Allowed 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.4 p -135.67 171.09 14.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.229 1.012 . . . . 0.0 109.592 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 m -156.12 148.91 24.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.335 -2.103 . . . . 0.0 107.557 -178.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -158.67 154.46 26.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -161.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -134.93 129.22 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -76.81 130.28 37.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 106.174 -1.788 . . . . 0.0 106.174 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -123.05 -16.39 7.03 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -156.58 147.29 21.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 119.423 1.01 . . . . 0.0 108.917 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -135.67 115.2 12.71 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.32 145.69 27.83 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.088 0.955 . . . . 0.0 109.453 174.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -79.45 167.07 21.31 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.918 0.487 . . . . 0.0 110.333 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.69 70.43 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.632 0.773 . . . . 0.0 112.909 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -85.39 -30.25 23.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.23 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 139.59 -0.74 2.25 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-O 118.434 -1.203 . . . . 0.0 115.065 176.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.5 m -64.79 108.64 1.8 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 120.822 2.311 . . . . 0.0 109.758 176.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.53 110.13 1.38 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.037 0.535 . . . . 0.0 109.737 165.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 42.7 mtt-85 -63.72 171.69 2.56 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.15 1.38 . . . . 0.0 110.106 173.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.84 127.08 43.55 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 m -129.8 155.23 80.79 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.605 0.762 . . . . 0.0 109.566 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.35 103.48 1.69 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.62 2.213 . . . . 0.0 110.257 178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.2 m -61.1 158.25 14.14 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 166.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.7 -17.13 62.67 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.172 0.989 . . . . 0.0 113.467 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -72.39 -12.07 60.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.641 0.655 . . . . 0.0 112.662 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.0 -22.04 18.8 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 -165.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.39 -9.42 8.28 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 164.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.78 76.21 3.83 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.418 1.887 . . . . 0.0 110.031 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.93 160.97 46.11 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 123.897 3.065 . . . . 0.0 111.678 -178.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -89.23 107.01 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 124.077 0.951 . . . . 0.0 109.313 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.1 p -112.39 154.33 25.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.914 1.286 . . . . 0.0 109.596 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.22 143.07 50.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 127.724 2.41 . . . . 0.0 106.627 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.2 m -137.3 128.57 27.97 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 68.0 mt -120.09 118.56 30.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 104.858 -2.275 . . . . 0.0 104.858 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -168.71 168.36 10.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -75.29 48.66 0.43 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.051 0.94 . . . . 0.0 110.636 168.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -69.93 -20.66 63.34 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 112.402 -171.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.2 p -98.21 -0.02 44.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.54 1.136 . . . . 0.0 111.459 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.44 -17.16 57.09 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.972 1.748 . . . . 0.0 111.955 -161.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -122.51 170.19 10.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.901 1.85 . . . . 0.0 110.87 -175.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -71.53 81.46 0.81 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 123.725 0.81 . . . . 0.0 109.913 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -126.32 113.4 16.88 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.86 1.264 . . . . 0.0 107.69 -170.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.64 148.63 51.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.534 169.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 p -147.19 165.67 29.31 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 125.084 1.354 . . . . 0.0 107.744 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 165.53 -174.75 41.32 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -122.66 113.98 19.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.3 m -125.57 94.41 4.13 Favored 'General case' 0 CA--C 1.516 -0.36 0 O-C-N 123.685 0.616 . . . . 0.0 110.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.0 -101.93 1.4 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 108.077 -2.009 . . . . 0.0 108.077 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -138.07 25.98 2.72 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.819 1.31 . . . . 0.0 111.187 164.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -140.79 128.48 21.57 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 -170.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -73.42 147.83 43.86 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.803 -0.561 . . . . 0.0 110.304 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -123.72 169.32 11.63 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 125.143 1.377 . . . . 0.0 110.373 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -161.17 169.13 22.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.953 1.701 . . . . 0.0 109.189 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.21 173.62 25.0 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.642 1.591 . . . . 0.0 110.127 166.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.5 p -79.46 165.45 23.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.275 1.038 . . . . 0.0 111.021 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.3 p90 -140.34 174.54 10.41 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.154 0.582 . . . . 0.0 111.449 172.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.73 150.82 26.61 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.612 1.565 . . . . 0.0 109.072 174.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.67 128.55 55.33 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 123.887 0.875 . . . . 0.0 108.829 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.7 ptpt -164.14 162.22 22.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.35 1.86 . . . . 0.0 109.002 173.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 52.2 22.55 1.99 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.579 2.352 . . . . 0.0 114.749 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.62 12.79 84.11 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-O 118.388 -1.229 . . . . 0.0 112.973 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -124.98 171.01 10.56 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.588 1.555 . . . . 0.0 112.47 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.583 ' O ' HG21 ' A' ' 115' ' ' ILE . 50.7 tp -109.94 100.14 9.14 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.832 1.653 . . . . 0.0 107.237 175.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 m -79.22 155.98 28.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.471 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.7 m-85 -120.36 159.13 25.67 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.44 0.696 . . . . 0.0 109.802 173.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.9 -155.95 30.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.7 m -63.17 95.6 0.09 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.523 1.129 . . . . 0.0 108.965 166.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 112' ' ' LEU . 19.5 mt -79.41 175.46 10.58 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 126.281 1.832 . . . . 0.0 110.571 168.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.88 177.33 33.9 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 168.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.25 -132.18 1.97 Allowed Glycine 0 CA--C 1.522 0.508 0 CA-C-O 118.234 -1.314 . . . . 0.0 110.291 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.3 p -143.78 156.2 44.42 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.147 1.779 . . . . 0.0 111.032 -173.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -103.55 61.29 0.76 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 122.146 0.974 . . . . 0.0 108.526 -163.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 18.7 mtm -71.03 172.12 9.66 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 167.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -131.73 124.81 30.52 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.544 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 6.3 m -118.16 8.39 12.35 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 117.317 -1.325 . . . . 0.0 113.067 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 25.4 ptp 44.67 41.14 4.66 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.208 1.803 . . . . 0.0 113.869 173.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.01 156.15 65.26 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.09 0.956 . . . . 0.0 109.838 -167.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.24 -36.92 6.47 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.211 2.608 . . . . 0.0 110.924 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.26 -3.97 89.82 Favored Glycine 0 C--O 1.219 -0.834 0 CA-C-O 117.436 -1.758 . . . . 0.0 111.289 174.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -85.47 -61.06 1.74 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-N 120.897 2.349 . . . . 0.0 111.888 170.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.99 -18.4 63.24 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -172.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -61.26 -8.01 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.976 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -44.42 -48.73 9.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 119.276 0.944 . . . . 0.0 111.073 162.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.94 -52.38 52.61 Favored Glycine 0 C--N 1.337 0.595 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.82 -43.95 97.83 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.517 0.727 . . . . 0.0 110.631 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -62.17 -48.43 80.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.29 1.036 . . . . 0.0 109.944 -173.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.0 mt -59.83 -37.21 78.57 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.312 0.505 . . . . 0.0 110.741 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -16.75 64.38 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.34 -7.17 32.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.064 1.345 . . . . 0.0 111.618 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 90' ' ' LEU . 91.0 mt -83.67 -13.39 54.25 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.181 1.355 . . . . 0.0 111.66 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -5.06 59.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.43 1.092 . . . . 0.0 113.445 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -134.33 78.58 1.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.421 1.089 . . . . 0.0 108.408 -171.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.583 HG21 ' O ' ' A' ' 85' ' ' LEU . 27.5 mm -103.71 35.6 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.081 1.352 . . . . 0.0 110.337 -172.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -23.35 67.18 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.527 -1.983 . . . . 0.0 113.605 -164.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -124.5 158.3 33.23 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.156 1.382 . . . . 0.0 109.025 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 51.6 m -155.56 124.83 6.25 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.051 -1.031 . . . . 0.0 110.943 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -101.61 131.15 10.48 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 127.311 2.386 . . . . 0.0 110.383 171.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' A' ' 19' ' ' ALA . 1.7 p -137.48 138.29 44.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 O-C-N 120.223 -1.751 . . . . 0.0 107.974 159.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.85 97.25 5.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 169.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.505 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 29.7 mtp -76.73 -5.51 48.37 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 127.06 30.29 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.578 1.551 . . . . 0.0 108.599 158.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.0 137.97 53.39 Favored Pre-proline 0 N--CA 1.445 -0.72 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -83.45 110.21 1.77 Allowed 'Cis proline' 0 CA--C 1.536 0.615 0 CA-C-N 120.615 1.255 . . . . 0.0 111.675 9.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 122' ' ' MET . 79.7 mt-30 -68.66 129.67 40.62 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.93 1.292 . . . . 0.0 111.374 -164.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -141.26 112.1 7.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.549 0.69 . . . . 0.0 109.449 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 56.4 ttp -75.96 157.09 33.54 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.1 112.0 5.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 121.381 -0.824 . . . . 0.0 109.596 177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 79.2 mt -86.72 156.78 19.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.1 t -142.72 137.81 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.49 167.35 10.67 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -62.08 -19.92 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.008 1.323 . . . . 0.0 113.327 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.33 -32.55 60.96 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.003 0.82 . . . . 0.0 109.865 172.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.63 0.51 20.04 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 117.84 -1.534 . . . . 0.0 113.425 -165.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.37 159.07 13.18 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.025 1.913 . . . . 0.0 108.784 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 m -138.45 141.07 39.5 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.666 1.121 . . . . 0.0 109.088 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -132.78 111.39 11.07 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 120.423 -1.423 . . . . 0.0 108.179 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.3 m -88.47 118.65 28.26 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 124.94 1.296 . . . . 0.0 110.238 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -110.25 139.77 45.09 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.891 0.876 . . . . 0.0 110.742 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.99 153.99 33.97 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 160.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -69.75 147.49 50.41 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 158.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 1.6 t -138.81 101.39 4.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 p -81.31 -5.27 57.64 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 . . . . . 0 C--O 1.254 1.301 0 CA-C-O 117.105 -1.426 . . . . 0.0 111.144 -142.178 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 . . . . . 0 CA--C 1.543 0.68 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -125.13 144.04 46.09 Favored Pre-proline 0 N--CA 1.474 0.772 0 O-C-N 121.405 -0.809 . . . . 0.0 112.621 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.06 -23.17 18.6 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.711 2.941 . . . . 0.0 111.977 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.45 -25.72 2.8 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.198 1.399 . . . . 0.0 113.729 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.72 -2.38 57.01 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.065 -1.022 . . . . 0.0 113.311 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 m -56.03 -59.04 5.48 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 119.168 0.895 . . . . 0.0 110.44 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.418 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.16 -14.96 12.09 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -177.494 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.3 -5.62 58.69 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 118.714 0.688 . . . . 0.0 109.573 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.96 -11.85 61.09 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 120.844 -1.16 . . . . 0.0 112.418 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.07 -8.12 46.84 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -167.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -138.18 62.72 1.56 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.486 1.914 . . . . 0.0 106.61 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.2 p -141.34 -176.13 4.6 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 120.611 -1.306 . . . . 0.0 110.97 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 8.1 m -144.81 -60.08 0.36 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.901 176.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 7.1 m95 68.68 159.54 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.128 1.371 . . . . 0.0 112.217 -176.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 t -136.61 129.38 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.541 HD11 HD12 ' A' ' 138' ' ' LEU . 52.1 tp -67.75 151.18 47.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 t -144.46 -23.36 0.53 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.06 146.13 29.9 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 121.202 1.819 . . . . 0.0 110.188 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.696 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.8 t90 -135.66 110.84 8.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.8 139.19 34.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -64.68 -170.17 0.05 OUTLIER 'General case' 0 C--O 1.237 0.436 0 CA-C-N 118.729 0.695 . . . . 0.0 110.559 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.71 -28.91 65.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.276 -1.515 . . . . 0.0 113.521 174.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -81.81 -45.47 15.53 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 123.242 1.496 . . . . 0.0 111.216 -165.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 140.81 -5.1 2.5 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 128.107 2.765 . . . . 0.0 112.709 -166.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -62.32 99.91 0.16 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.818 1.309 . . . . 0.0 109.689 167.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.73 122.29 12.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 159.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.7 156.05 35.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.82 146.56 53.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 162.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.6 m -141.31 156.29 67.45 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 161.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.608 1.539 . . . . 0.0 109.307 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.08 159.44 11.74 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.52 -1.363 . . . . 0.0 108.739 163.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.776 0.43 . . . . 0.0 111.552 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -19.78 66.05 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -65.86 -16.31 63.71 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.231 0.612 . . . . 0.0 112.638 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.29 -45.77 0.88 Allowed Glycine 0 C--N 1.337 0.628 0 C-N-CA 125.518 1.533 . . . . 0.0 111.174 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 68' ' ' PHE . . . -157.39 86.7 2.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.565 -155.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.07 161.27 46.6 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.814 2.343 . . . . 0.0 111.634 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.3 mt -80.36 108.48 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 125.539 1.536 . . . . 0.0 109.05 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.2 p -91.85 169.79 10.4 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 122.178 0.989 . . . . 0.0 110.649 172.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -130.58 167.33 18.89 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 161.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 10.7 m -145.64 133.6 21.36 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 170.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.4 mt -133.0 82.15 1.98 Allowed 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 t -150.23 -154.97 0.59 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.942 1.297 . . . . 0.0 107.755 175.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.3 p -128.78 43.37 3.16 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.293 1.437 . . . . 0.0 111.993 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.8 t -57.16 -41.84 79.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.466 -1.396 . . . . 0.0 112.461 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -76.75 -31.62 57.21 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 120.415 -1.428 . . . . 0.0 110.259 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 124.19 -23.86 6.39 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 127.986 2.708 . . . . 0.0 111.243 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -82.44 165.33 20.32 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.693 1.246 . . . . 0.0 109.079 170.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -74.37 80.13 1.88 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -117.33 155.89 28.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 120.365 -1.46 . . . . 0.0 111.07 171.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.66 144.33 28.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 p -150.63 65.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 122.514 1.149 . . . . 0.0 110.23 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -103.57 -175.98 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.272 0.939 . . . . 0.0 111.394 -172.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 35.9 t80 -109.35 119.42 39.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 168.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.05 168.78 10.4 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 171.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.89 -42.73 8.0 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 -144.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 49.4 t -129.38 -5.96 4.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.596 1.198 . . . . 0.0 112.67 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -131.6 123.19 27.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.3 mtt-85 -56.98 169.77 0.49 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.088 0.555 . . . . 0.0 111.863 177.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -142.19 156.21 45.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.832 175.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -154.15 155.54 35.52 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.763 1.225 . . . . 0.0 109.206 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.75 -98.32 0.11 Allowed Glycine 0 C--O 1.228 -0.273 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 7.9 m -162.75 154.28 17.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.097 1.759 . . . . 0.0 108.017 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 7.4 p90 -139.11 167.55 21.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.462 1.028 . . . . 0.0 111.519 169.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.76 143.05 26.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.651 1.18 . . . . 0.0 108.298 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.64 116.35 28.97 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 166.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -150.99 162.06 41.55 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.811 1.245 . . . . 0.0 107.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 56.14 26.32 10.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.352 1.461 . . . . 0.0 113.612 166.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.83 21.08 65.0 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.463 -1.187 . . . . 0.0 112.814 -175.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.551 ' HA ' HG21 ' A' ' 118' ' ' THR . 16.7 pttp -135.93 166.78 22.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.389 1.594 . . . . 0.0 112.18 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.28 145.12 44.24 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 164.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -141.6 161.85 36.91 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.175 -0.953 . . . . 0.0 108.762 167.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 90.6 m-85 -130.67 164.04 25.89 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.353 0.661 . . . . 0.0 111.107 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.05 -151.68 26.89 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 125.171 1.367 . . . . 0.0 110.051 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 t -66.66 121.23 14.93 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 171.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -111.26 166.84 10.75 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.569 1.948 . . . . 0.0 110.852 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 163.86 -167.48 37.96 Favored Glycine 0 CA--C 1.523 0.574 0 O-C-N 121.774 -0.579 . . . . 0.0 111.784 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -178.86 -156.79 18.05 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 126.164 1.84 . . . . 0.0 109.209 -176.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.7 t -90.8 170.37 10.16 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.667 1.233 . . . . 0.0 108.768 160.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.2 mtm180 -118.06 85.56 2.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 164.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.1 mtm -82.2 154.45 25.44 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.41 122.79 30.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 57.4 m -123.86 -32.57 3.27 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 123.809 0.844 . . . . 0.0 111.761 -170.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 16.9 ptp 45.88 56.05 6.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.909 1.684 . . . . 0.0 111.854 -175.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.7 p -144.07 159.59 52.31 Favored Pre-proline 0 C--O 1.238 0.471 0 C-N-CA 124.079 0.952 . . . . 0.0 110.847 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.29 -29.57 13.91 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.765 2.31 . . . . 0.0 111.657 174.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.14 -7.08 84.23 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.316 -0.865 . . . . 0.0 111.102 167.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.95 -42.67 4.64 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 120.202 2.001 . . . . 0.0 111.549 173.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.66 -19.19 61.47 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 121.518 -0.989 . . . . 0.0 112.89 -172.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.6 tt -65.35 -15.86 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.516 1.126 . . . . 0.0 113.333 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.9 -50.12 19.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.736 1.214 . . . . 0.0 111.076 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.28 -19.56 71.61 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.634 -0.666 . . . . 0.0 113.228 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.3 -50.89 23.54 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.721 1.261 . . . . 0.0 108.307 169.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -63.09 -48.49 78.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.4 0.68 . . . . 0.0 110.252 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 30.3 mt -60.37 -27.74 67.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.031 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -68.2 -55.59 11.72 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.57 0.623 . . . . 0.0 109.61 171.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.89 69.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.671 1.189 . . . . 0.0 112.46 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.6 mt -65.58 -3.37 4.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.854 0.862 . . . . 0.0 113.215 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 65.9 p -102.42 11.65 37.69 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.519 1.054 . . . . 0.0 111.822 169.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -135.69 43.77 2.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.793 1.637 . . . . 0.0 110.656 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 115' ' ' ILE . 4.1 mp -79.97 91.33 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 O-C-N 119.478 -2.014 . . . . 0.0 105.72 159.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.84 -27.83 24.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 168.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.524 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -147.19 165.84 28.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.389 2.676 . . . . 0.0 114.016 -172.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.551 HG21 ' HA ' ' A' ' 84' ' ' LYS . 12.1 t -161.0 163.62 31.57 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.994 1.318 . . . . 0.0 108.792 -178.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.62 92.24 0.2 Allowed Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 108.394 -1.883 . . . . 0.0 108.394 172.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 93.0 t -80.73 125.22 39.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 119.412 1.606 . . . . 0.0 108.774 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.74 85.7 2.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.656 1.582 . . . . 0.0 107.933 -174.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -11.88 59.92 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.927 1.291 . . . . 0.0 113.74 -175.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.85 138.4 42.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.904 1.281 . . . . 0.0 109.01 160.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 150.87 97.55 Favored Pre-proline 0 N--CA 1.445 -0.692 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 164.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.28 119.73 4.5 Favored 'Cis proline' 0 N--CA 1.456 -0.721 0 N-CA-C 109.087 -1.159 . . . . 0.0 109.087 -12.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -62.59 132.01 50.94 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.566 0.747 . . . . 0.0 110.857 -167.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -143.1 170.9 14.85 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.182 1.393 . . . . 0.0 109.8 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 42.5 ttp -139.88 118.28 12.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.071 1.348 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -79.18 150.71 31.61 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 158.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 96.3 mt -116.78 147.78 41.77 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 153.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.524 ' HB ' ' HG3' ' A' ' 117' ' ' ARG . 58.4 t -124.76 131.07 73.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 171.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 10.9 mp -78.68 160.53 27.45 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -48.67 -36.63 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.877 -1.511 . . . . 0.0 112.38 171.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.49 -14.43 58.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.799 0.84 . . . . 0.0 110.27 -173.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 109.64 0.77 30.73 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.352 0.977 . . . . 0.0 114.183 -174.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.46 153.39 35.56 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.99 1.395 . . . . 0.0 109.563 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.5 m -132.25 104.5 6.79 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.754 -0.591 . . . . 0.0 109.925 -167.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.696 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.4 mm? -104.91 150.98 24.42 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 30' ' ' LEU . 46.5 m -141.76 123.96 15.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.058 0.943 . . . . 0.0 109.716 -167.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 5.2 m-85 -122.41 139.49 53.78 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.69 1.596 . . . . 0.0 109.438 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.22 147.34 29.01 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.447 1.499 . . . . 0.0 108.536 168.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 101.24 6.62 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 120.671 -1.268 . . . . 0.0 109.457 168.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t -84.48 118.36 24.25 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 148.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.0 m -138.53 65.19 1.47 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.353 1.861 . . . . 0.0 106.462 152.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 126.853 2.061 . . . . 0.0 107.285 168.074 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 . . . . . 0 C--O 1.233 0.223 0 CA-C-O 120.547 0.213 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -150.17 144.5 17.61 Favored Pre-proline 0 N--CA 1.435 -1.177 0 O-C-N 120.35 -1.469 . . . . 0.0 111.382 177.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.04 -41.0 10.56 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.825 2.35 . . . . 0.0 110.73 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.03 22.21 0.11 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.911 1.284 . . . . 0.0 112.289 175.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.55 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -103.08 -27.35 12.63 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 119.626 1.103 . . . . 0.0 111.832 160.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.0 m -70.91 -21.75 62.33 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.018 1.327 . . . . 0.0 112.998 -171.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -22.15 4.37 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.443 1.897 . . . . 0.0 113.445 165.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 mt -107.19 50.65 0.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.561 -171.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.3 mt -121.66 21.65 10.77 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.238 1.415 . . . . 0.0 110.27 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.39 -11.12 41.47 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.237 -0.915 . . . . 0.0 112.356 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -128.79 -6.63 5.07 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -83.06 -177.78 6.88 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.608 1.163 . . . . 0.0 112.833 -166.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -136.83 -64.87 0.57 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.056 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 66.28 162.5 0.16 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.012 1.725 . . . . 0.0 113.581 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.4 t -139.82 146.93 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -97.06 133.45 41.71 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.65 -3.76 1.85 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.61 149.81 27.03 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.925 1.239 . . . . 0.0 112.171 166.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.754 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.6 t90 -137.55 132.67 33.51 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.328 2.651 . . . . 0.0 108.154 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.33 147.15 46.06 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.124 1.769 . . . . 0.0 109.405 174.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -90.85 178.13 6.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.901 0.319 . . . . 0.0 110.301 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.52 69.35 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.966 0.506 . . . . 0.0 112.318 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -100.2 18.95 17.42 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.052 0.454 . . . . 0.0 110.793 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.6 8.83 79.74 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.018 -1.676 . . . . 0.0 112.268 170.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -66.41 100.98 0.69 Allowed 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 125.728 1.611 . . . . 0.0 108.181 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.4 106.11 1.64 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.457 1.026 . . . . 0.0 109.882 168.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -64.7 156.06 31.54 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.572 0.749 . . . . 0.0 110.183 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 142.46 54.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 167.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.5 m -144.23 159.52 52.06 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 125.656 1.583 . . . . 0.0 108.039 168.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -75.21 115.1 4.16 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.998 2.465 . . . . 0.0 110.435 171.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 166.83 12.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.49 1.916 . . . . 0.0 109.34 166.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.25 -52.42 65.67 Favored 'General case' 0 C--O 1.23 0.07 0 O-C-N 121.87 -0.519 . . . . 0.0 111.44 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -8.4 26.17 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.33 -15.41 50.14 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 120.892 -1.13 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.66 -81.27 0.27 Allowed Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.45 85.48 7.21 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 125.497 1.519 . . . . 0.0 107.998 -174.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -67.73 164.07 32.77 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.829 2.353 . . . . 0.0 110.443 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 70' ' ' GLY . 41.0 mt -79.85 107.03 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.3 p -113.43 129.95 56.42 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.3 tp -95.43 155.34 16.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.783 1.633 . . . . 0.0 106.598 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m -144.76 118.52 9.25 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.8 mt -117.12 85.59 2.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 -174.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.38 172.45 12.93 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.799 0.84 . . . . 0.0 110.231 -172.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.0 p -103.1 24.58 10.61 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.664 1.586 . . . . 0.0 112.873 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.94 -47.09 52.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.701 1.591 . . . . 0.0 112.616 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -74.6 3.03 8.43 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 118.995 0.816 . . . . 0.0 112.995 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.92 -27.36 20.78 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 127.388 2.423 . . . . 0.0 111.829 -171.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -120.27 152.7 37.4 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 118.316 1.058 . . . . 0.0 111.16 -172.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.1 ptp85 -65.6 96.88 0.28 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.59 154.27 49.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.242 1.017 . . . . 0.0 109.204 170.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.55 111.75 23.51 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.947 -1.871 . . . . 0.0 105.947 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.1 p -124.58 86.61 2.59 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.139 1.376 . . . . 0.0 108.354 -169.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 168.13 24.91 Favored Glycine 0 N--CA 1.469 0.873 0 O-C-N 120.994 -1.066 . . . . 0.0 111.514 -163.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.401 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 22.8 t80 -95.31 102.43 14.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 123.846 0.858 . . . . 0.0 109.752 -177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 p -93.28 99.27 11.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 119.161 0.891 . . . . 0.0 109.001 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.427 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 75.07 -70.36 1.82 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 124.497 1.046 . . . . 0.0 112.784 166.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 28.3 t -130.94 -14.27 3.51 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.858 1.263 . . . . 0.0 112.797 175.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -133.87 133.79 41.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -165.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 5.8 mtt180 -71.18 138.26 49.41 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 118.29 -1.364 . . . . 0.0 109.273 170.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -103.17 162.89 12.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.969 2.043 . . . . 0.0 109.409 168.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.96 161.61 41.97 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.752 2.021 . . . . 0.0 107.232 167.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -171.92 -108.92 0.22 Allowed Glycine 0 C--N 1.334 0.456 0 O-C-N 121.927 -0.483 . . . . 0.0 112.373 169.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.0 m -154.37 168.71 25.72 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 127.278 2.231 . . . . 0.0 106.795 166.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -142.48 171.56 13.89 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.088 0.555 . . . . 0.0 110.184 162.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -146.58 152.17 38.5 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.34 1.856 . . . . 0.0 107.868 170.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.8 128.39 45.9 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 172.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -164.23 164.36 22.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 125.732 1.613 . . . . 0.0 108.639 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.88 4.88 2.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.33 6.08 89.43 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 118.576 -1.124 . . . . 0.0 112.316 -166.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.4 pttp -123.24 168.27 12.66 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 126.34 1.856 . . . . 0.0 110.846 -173.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.64 135.45 35.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 169.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.29 131.48 55.76 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 165.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.413 ' CB ' HD11 ' A' ' 90' ' ' LEU . 98.3 m-85 -97.97 161.32 13.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.09 -147.9 16.83 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -57.59 99.99 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.532 0.733 . . . . 0.0 109.049 167.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.553 HD13 HD23 ' A' ' 112' ' ' LEU . 61.2 mt -98.24 142.8 29.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.069 1.348 . . . . 0.0 108.599 170.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.15 -177.01 48.32 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.08 -168.55 32.11 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -172.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.9 p -75.61 173.32 11.2 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.988 2.515 . . . . 0.0 112.468 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -122.02 84.2 2.22 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 126.12 1.768 . . . . 0.0 108.899 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 11.0 mtt -73.68 -174.48 1.77 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.21 1.404 . . . . 0.0 108.155 159.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -142.63 109.77 5.59 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 120.824 1.647 . . . . 0.0 111.658 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 68.2 m -93.98 -14.79 25.52 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.764 -1.112 . . . . 0.0 112.442 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp 47.34 28.12 1.01 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.973 1.709 . . . . 0.0 114.824 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -117.57 164.33 19.94 Favored Pre-proline 0 C--O 1.239 0.513 0 C-N-CA 126.432 1.893 . . . . 0.0 109.936 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.92 -14.85 26.5 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.244 1.963 . . . . 0.0 113.788 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.31 -2.26 74.01 Favored Glycine 0 C--O 1.222 -0.604 0 CA-C-O 117.675 -1.625 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.75 -58.62 1.59 Allowed Glycine 0 C--N 1.337 0.587 0 CA-C-N 119.958 1.879 . . . . 0.0 112.803 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.07 -3.59 20.6 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -173.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -65.15 -10.48 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.135 0.974 . . . . 0.0 112.317 171.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -44.61 -60.68 1.87 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.265 1.426 . . . . 0.0 110.68 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.85 -30.11 77.1 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 118.501 -1.166 . . . . 0.0 112.333 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.45 -43.91 76.04 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.306 1.553 . . . . 0.0 109.845 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.72 -49.01 74.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.999 0.92 . . . . 0.0 109.758 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.39 -36.03 75.05 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.465 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -51.95 61.99 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.191 0.996 . . . . 0.0 110.123 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.79 -30.46 68.0 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.534 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.553 HD23 HD13 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -62.45 -22.11 65.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.379 1.472 . . . . 0.0 112.527 177.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.0 p -73.08 -27.51 61.76 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.544 -0.722 . . . . 0.0 111.157 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -114.96 49.57 1.04 Allowed 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 126.26 1.824 . . . . 0.0 110.05 -165.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.408 HD12 HD23 ' A' ' 130' ' ' LEU . 8.5 mm -75.41 69.15 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 166.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.64 -32.7 60.32 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 120.818 -1.176 . . . . 0.0 109.286 177.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -133.67 160.18 38.31 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.554 1.542 . . . . 0.0 110.366 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -155.47 166.5 33.35 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.131 -0.981 . . . . 0.0 109.886 -162.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.55 76.1 0.09 OUTLIER Glycine 0 CA--C 1.531 1.069 0 CA-C-N 118.61 0.641 . . . . 0.0 113.131 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.255 5.2 p -86.17 127.17 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.173 -1.781 . . . . 0.0 110.314 171.583 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -99.58 80.71 2.4 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.367 1.467 . . . . 0.0 107.041 173.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.427 ' HG3' HE21 ' A' ' 126' ' ' GLN . 27.8 ttm -82.18 63.38 6.36 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.843 1.656 . . . . 0.0 110.966 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -139.32 130.01 25.98 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 165.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.45 137.16 16.69 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 168.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.61 122.06 7.12 Favored 'Cis proline' 0 CA--C 1.542 0.876 0 CA-C-N 119.419 0.828 . . . . 0.0 111.383 -6.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . 0.427 HE21 ' HG3' ' A' ' 122' ' ' MET . 58.6 mt-30 -75.7 135.77 40.38 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.376 1.07 . . . . 0.0 110.93 -169.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -146.19 176.19 9.93 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 125.972 1.709 . . . . 0.0 108.839 165.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -141.7 134.09 28.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.076 1.75 . . . . 0.0 108.027 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -112.22 155.25 24.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 126.611 1.964 . . . . 0.0 109.329 172.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -138.78 155.39 48.22 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 127.127 2.171 . . . . 0.0 109.904 162.526 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.5 t -134.06 136.59 53.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 177.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -88.2 174.26 8.32 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 122.154 0.978 . . . . 0.0 111.287 -174.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -54.41 -39.71 67.55 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.619 1.968 . . . . 0.0 111.882 163.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -84.23 -20.81 31.64 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 126.491 1.916 . . . . 0.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 95.87 20.82 25.17 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-O 118.837 -0.98 . . . . 0.0 114.369 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.82 155.91 3.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.032 1.416 . . . . 0.0 108.729 163.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.06 110.55 11.71 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 126.037 1.735 . . . . 0.0 106.676 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.754 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -116.61 150.38 38.17 Favored 'General case' 0 CA--C 1.515 -0.366 0 O-C-N 121.451 -0.781 . . . . 0.0 109.239 -172.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 38.7 m -138.4 103.79 4.99 Favored 'General case' 0 C--O 1.239 0.541 0 O-C-N 124.277 0.986 . . . . 0.0 111.419 -162.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.469 ' HE1' HD11 ' A' ' 130' ' ' LEU . 96.2 m-85 -92.59 168.8 10.99 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.707 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.39 143.58 47.37 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 126.573 1.949 . . . . 0.0 107.698 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -75.76 104.02 6.12 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.539 -1.351 . . . . 0.0 108.978 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 2.6 t -99.3 115.84 30.09 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 150.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 p -128.06 1.1 5.89 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.87 1.268 . . . . 0.0 112.629 156.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 C--O 1.258 1.547 0 C-N-CA 131.239 3.815 . . . . 0.0 104.164 -167.54 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 121.788 0.804 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 156.98 45.37 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 123.698 0.799 . . . . 0.0 111.627 -176.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.89 -38.0 31.77 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.898 3.065 . . . . 0.0 112.883 176.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.8 19.61 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.449 2.3 . . . . 0.0 115.468 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.84 -8.64 1.39 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.46 1.504 . . . . 0.0 113.261 -170.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.537 HG23 HD12 ' A' ' 23' ' ' LEU . 5.5 m -79.53 -19.37 49.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.971 1.26 . . . . 0.0 112.801 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -57.03 -19.23 17.57 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.124 1.329 . . . . 0.0 113.702 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 3.84 51.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.72 0.691 . . . . 0.0 110.388 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.537 HD12 HG23 ' A' ' 20' ' ' THR . 32.3 mt -84.99 66.19 9.63 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.492 1.042 . . . . 0.0 110.633 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -120.48 -48.35 2.3 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 124.125 0.97 . . . . 0.0 112.502 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -127.95 57.8 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.2 p -139.98 160.89 38.9 Favored 'General case' 0 C--N 1.337 0.055 0 CA-C-O 122.084 0.945 . . . . 0.0 110.63 -173.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.524 ' H ' ' NH1' ' A' ' 142' ' ' ARG . 3.2 p -142.49 136.43 29.38 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 124.123 0.969 . . . . 0.0 109.008 -158.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 47.8 m95 -149.97 165.22 33.31 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.855 0.722 . . . . 0.0 109.901 -165.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 70.4 t -142.01 123.53 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.52 130.84 45.21 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.55 -6.08 2.54 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.552 0.533 . . . . 0.0 111.918 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.9 162.13 36.87 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.019 -1.051 . . . . 0.0 110.918 169.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -145.76 116.69 7.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.63 138.72 38.24 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 174.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -71.28 167.27 19.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 118.574 0.625 . . . . 0.0 109.344 167.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.4 -30.16 70.38 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.18 0.592 . . . . 0.0 112.393 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -74.86 -45.07 45.49 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.69 3.47 1.78 Allowed Glycine 0 CA--C 1.531 1.035 0 CA-C-O 119.118 -0.823 . . . . 0.0 113.792 -172.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.6 m -65.04 101.63 0.53 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.377 2.089 . . . . 0.0 108.379 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.86 108.41 0.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.028 -1.045 . . . . 0.0 109.398 165.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -66.65 161.83 22.47 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.098 0.959 . . . . 0.0 110.446 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.38 145.34 39.48 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 158.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 m -140.49 165.42 30.22 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.424 1.89 . . . . 0.0 107.561 168.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.97 127.44 13.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 CA-C-N 120.556 1.234 . . . . 0.0 110.884 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.77 162.44 16.04 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.819 1.248 . . . . 0.0 112.002 164.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.15 -36.63 61.06 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.497 -0.752 . . . . 0.0 110.443 164.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.9 -21.06 60.21 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.936 0.895 . . . . 0.0 112.957 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -70.36 -11.86 61.2 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.574 -0.704 . . . . 0.0 112.523 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.1 -1.63 38.05 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 118.437 -1.202 . . . . 0.0 113.389 175.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB1' ' HE1' ' A' ' 68' ' ' PHE . . . -169.6 83.6 0.62 Allowed Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.844 1.258 . . . . 0.0 111.064 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.6 157.09 63.27 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 121.97 1.78 . . . . 0.0 110.357 171.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 32.2 mt -87.25 111.55 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.1 p -123.37 132.29 53.93 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -169.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.1 tp -111.58 134.5 53.11 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 124.993 1.317 . . . . 0.0 108.527 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.1 m -124.14 140.65 52.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 167.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.4 mt -123.3 121.56 36.15 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.9 t -172.67 -174.26 1.12 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.2 p -113.5 36.05 3.76 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.067 1.347 . . . . 0.0 112.545 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.8 m -49.12 -14.63 0.08 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 170.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -113.07 3.12 15.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.295 1.407 . . . . 0.0 111.096 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.02 -13.23 39.13 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 119.902 1.228 . . . . 0.0 111.692 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -113.67 166.07 11.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 121.232 -1.157 . . . . 0.0 110.422 164.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -55.47 115.78 2.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.642 1.177 . . . . 0.0 110.046 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.96 168.86 19.25 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.273 1.029 . . . . 0.0 108.403 176.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.13 73.47 1.45 Allowed 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.443 1.097 . . . . 0.0 109.12 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 t -68.98 116.42 9.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.73 175.84 25.03 Favored Glycine 0 C--N 1.328 0.087 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -167.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.584 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 29.6 t80 -129.56 106.87 9.04 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.3 m -78.05 -177.14 4.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.126 0.971 . . . . 0.0 108.796 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.98 -30.5 1.75 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 126.277 1.894 . . . . 0.0 117.324 -163.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.8 OUTLIER -147.58 6.88 0.84 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 119.403 1.601 . . . . 0.0 114.502 156.282 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.41 ' ND2' ' H ' ' A' ' 95' ' ' MET . 10.5 m120 -134.05 122.29 22.75 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -160.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -69.12 146.78 52.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.232 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -130.58 166.15 21.23 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 126.238 1.815 . . . . 0.0 109.422 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.1 ptp -154.7 163.21 40.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.448 1.899 . . . . 0.0 108.066 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 154.41 172.04 21.9 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 46.1 p -94.6 153.74 17.7 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.156 1.382 . . . . 0.0 111.589 -170.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -108.99 166.29 10.94 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.497 0.665 . . . . 0.0 110.764 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.11 122.2 7.7 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.112 1.365 . . . . 0.0 107.862 177.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.1 mt -101.47 111.84 24.2 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.565 1.546 . . . . 0.0 107.876 -172.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -154.52 163.53 40.06 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.171 1.788 . . . . 0.0 108.807 -175.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.7 29.24 2.11 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.694 2.398 . . . . 0.0 116.953 163.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.16 11.73 71.1 Favored Glycine 0 CA--C 1.533 1.196 0 O-C-N 120.85 -1.156 . . . . 0.0 113.228 -174.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -129.6 165.65 21.32 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.737 2.415 . . . . 0.0 112.242 -170.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.89 92.07 3.63 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.5 t -86.69 167.14 14.76 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -129.44 173.56 10.44 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.413 1.085 . . . . 0.0 110.702 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -106.34 -136.75 8.46 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 127.783 2.611 . . . . 0.0 108.942 170.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.9 m -64.42 83.65 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.771 1.629 . . . . 0.0 111.546 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.0 mt -77.02 143.33 39.43 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 120.848 -1.157 . . . . 0.0 108.929 169.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.83 -176.63 46.33 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.68 -141.66 3.27 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.518 0.659 . . . . 0.0 112.347 -159.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.7 t -115.53 168.22 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 169.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -126.71 90.8 3.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 171.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . 0.41 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 9.6 mtm -102.68 172.85 6.61 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 168.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.78 107.12 8.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.542 1.519 . . . . 0.0 111.796 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.7 m -79.22 -7.18 58.05 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.183 0.993 . . . . 0.0 113.544 170.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 66.51 20.79 10.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.235 1.814 . . . . 0.0 113.227 176.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 p -127.03 161.31 54.58 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.099 1.76 . . . . 0.0 110.978 -170.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -37.4 5.68 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.37 2.047 . . . . 0.0 111.034 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.49 -30.5 75.11 Favored Glycine 0 C--O 1.22 -0.753 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.361 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -60.8 8.3 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.116 1.458 . . . . 0.0 109.889 167.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -81.82 1.86 32.82 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -164.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tt -78.99 -7.73 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.195 -0.941 . . . . 0.0 110.43 166.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.46 -59.28 2.5 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.689 1.596 . . . . 0.0 111.842 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.84 87.93 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 119.155 -0.803 . . . . 0.0 111.213 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.19 84.39 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 118.267 1.034 . . . . 0.0 109.985 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -64.38 -43.76 93.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.464 -0.779 . . . . 0.0 109.942 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.3 -38.02 76.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.885 1.221 . . . . 0.0 110.011 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -19.21 65.86 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.211 1.005 . . . . 0.0 113.631 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.6 -25.16 23.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.687 0.795 . . . . 0.0 110.681 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.78 11.62 3.77 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.908 1.283 . . . . 0.0 113.126 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.86 -5.99 15.36 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 125.667 1.587 . . . . 0.0 111.306 164.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -126.31 66.66 1.22 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.684 1.194 . . . . 0.0 108.415 -172.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 115' ' ' ILE . 3.1 mp -101.31 31.56 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 120.959 -1.088 . . . . 0.0 110.592 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -54.42 -29.06 48.0 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.232 -1.542 . . . . 0.0 113.435 -168.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -125.79 163.67 22.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.449 1.5 . . . . 0.0 110.02 170.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 93.6 m -157.97 165.81 34.18 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.355 1.462 . . . . 0.0 107.104 176.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -161.88 127.42 1.72 Allowed Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 169.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.74 142.35 16.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 118.874 1.337 . . . . 0.0 108.097 171.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.86 75.58 2.39 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 172.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.9 ttm -77.25 73.52 3.83 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.8 1.24 . . . . 0.0 107.757 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.5 140.22 12.37 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 171.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.2 132.19 95.01 Favored Pre-proline 0 N--CA 1.446 -0.674 0 N-CA-C 108.031 -1.099 . . . . 0.0 108.031 173.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -78.49 120.63 7.36 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 CA-C-N 119.925 1.009 . . . . 0.0 111.647 -1.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.67 131.18 45.11 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.56 0.695 . . . . 0.0 110.981 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -146.11 164.08 33.31 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.615 1.566 . . . . 0.0 106.948 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -138.48 147.96 43.8 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 125.842 1.657 . . . . 0.0 107.26 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -130.11 141.99 50.64 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 166.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.36 161.33 14.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 160.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.0 t -136.07 121.42 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.06 170.4 11.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.236 0.541 . . . . 0.0 111.158 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 46.1 p-10 -64.52 -26.11 68.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.481 169.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.58 -37.41 62.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 119.703 1.138 . . . . 0.0 108.848 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.53 10.92 9.94 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.373 -173.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -55.65 151.02 11.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 120.332 2.066 . . . . 0.0 108.628 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.6 m -130.41 96.67 4.2 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.802 0.841 . . . . 0.0 109.065 -175.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.04 133.07 36.82 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.623 1.169 . . . . 0.0 107.867 169.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.9 m -108.65 128.62 55.01 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.438 1.095 . . . . 0.0 109.431 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.87 131.07 54.19 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.725 1.21 . . . . 0.0 109.311 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.43 148.12 26.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.823 1.249 . . . . 0.0 109.62 172.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.524 ' NH1' ' H ' ' A' ' 27' ' ' SER . 34.0 tpt85 -70.26 132.94 46.48 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.737 -1.125 . . . . 0.0 108.423 173.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -133.87 60.91 1.69 Allowed 'General case' 0 C--N 1.347 0.47 0 CA-C-N 120.338 1.426 . . . . 0.0 110.517 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 3.77 7.92 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 ttm-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.195 1.398 . . . . 0.0 112.97 -169.804 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 CA--C 1.53 0.212 0 CA-C-O 121.034 0.445 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.82 144.45 89.94 Favored Pre-proline 0 N--CA 1.469 0.502 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.917 -177.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.53 -14.74 30.73 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 123.38 2.72 . . . . 0.0 112.528 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.64 31.9 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.405 1.882 . . . . 0.0 112.169 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -131.64 -28.3 1.84 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.741 -1.225 . . . . 0.0 112.213 -174.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.5 m -67.26 -17.23 64.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.994 0.815 . . . . 0.0 110.978 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -59.47 -11.26 4.22 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.961 1.304 . . . . 0.0 114.186 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.1 mt -106.6 7.72 30.85 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.526 1.53 . . . . 0.0 111.581 -172.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.37 51.8 0.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.121 1.368 . . . . 0.0 110.816 -172.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.45 0.95 0.81 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -165.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.0 -7.95 12.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.684 0.793 . . . . 0.0 111.451 148.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 80.8 p -73.83 -176.7 2.53 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.956 0.884 . . . . 0.0 112.047 -155.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -149.52 -68.42 0.21 Allowed 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.114 -2.241 . . . . 0.0 110.61 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.6 m95 69.78 163.44 0.24 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.822 1.249 . . . . 0.0 112.841 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.4 t -143.51 119.55 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.58 136.69 57.72 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.38 -11.51 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.95 151.37 28.44 Favored 'General case' 0 CA--C 1.515 -0.392 0 O-C-N 120.415 -1.428 . . . . 0.0 109.39 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -132.34 107.46 8.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -91.72 140.7 29.46 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -68.84 163.84 23.33 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.589 0.756 . . . . 0.0 110.372 166.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.52 69.82 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.708 0.803 . . . . 0.0 112.337 171.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -77.84 -21.22 51.8 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.502 0.592 . . . . 0.0 112.091 177.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.72 6.07 23.45 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.735 1.159 . . . . 0.0 114.669 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -68.28 115.41 7.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.877 2.071 . . . . 0.0 108.592 171.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.59 107.32 4.4 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.787 -1.196 . . . . 0.0 110.423 167.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.0 mtt180 -65.6 149.28 50.34 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.716 0.806 . . . . 0.0 110.18 173.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.97 139.59 58.78 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.104 0.562 . . . . 0.0 109.724 166.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -139.12 160.86 60.72 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 127.45 2.3 . . . . 0.0 108.574 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.78 116.06 4.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.532 2.155 . . . . 0.0 110.822 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.63 168.52 17.51 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.865 0.84 . . . . 0.0 111.597 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.26 -38.91 81.27 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.826 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -87.93 15.85 6.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.292 1.437 . . . . 0.0 111.597 176.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -105.76 -27.6 11.18 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.471 161.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.93 -27.33 3.67 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 123.545 0.593 . . . . 0.0 114.364 157.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -136.34 73.04 57.73 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 125.049 1.34 . . . . 0.0 110.101 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.11 143.54 78.56 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.858 1.705 . . . . 0.0 108.118 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 83.9 mt -70.83 99.56 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 125.526 1.53 . . . . 0.0 109.27 -169.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -87.41 149.85 24.19 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 126.544 1.938 . . . . 0.0 107.778 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 21.3 tp -127.87 157.8 39.52 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.299 1.44 . . . . 0.0 107.906 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.62 108.32 4.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.42 108.85 19.88 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 169.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 t -149.68 174.69 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.04 35.22 4.82 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.079 0.952 . . . . 0.0 109.924 171.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.2 t -48.35 -52.54 21.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.112 0.965 . . . . 0.0 110.224 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.5 t -84.52 10.23 11.48 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.656 1.182 . . . . 0.0 111.778 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.85 -38.63 2.82 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 127.016 2.246 . . . . 0.0 111.476 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -73.43 150.29 41.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 173.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -72.25 98.47 2.18 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 167.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.44 152.84 45.85 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 122.438 1.113 . . . . 0.0 110.375 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.93 133.37 41.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 153.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 53.5 p -116.24 172.0 7.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 141.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.93 175.1 39.27 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -109.64 94.62 5.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.6 m -73.56 80.21 1.47 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.697 0.761 . . . . 0.0 109.643 175.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.18 -51.57 4.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 124.388 0.994 . . . . 0.0 112.695 155.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -152.48 14.18 0.57 Allowed 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.924 -0.751 . . . . 0.0 111.873 153.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.7 110.32 6.71 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.775 -1.203 . . . . 0.0 108.304 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 136.06 40.45 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.957 1.703 . . . . 0.0 113.981 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -112.03 168.33 9.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 126.243 1.817 . . . . 0.0 110.788 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -152.73 156.72 39.69 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.142 1.777 . . . . 0.0 107.338 166.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -170.37 -109.29 0.22 Allowed Glycine 0 CA--C 1.525 0.711 0 O-C-N 121.622 -0.674 . . . . 0.0 111.883 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.6 168.88 22.69 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.405 1.482 . . . . 0.0 107.917 174.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -152.12 169.39 22.52 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.639 1.176 . . . . 0.0 110.661 170.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.18 157.15 42.3 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.77 1.628 . . . . 0.0 109.451 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.26 138.81 47.25 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.253 1.021 . . . . 0.0 108.834 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -162.31 164.69 27.36 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.922 2.089 . . . . 0.0 108.321 167.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.5 t0 51.67 32.83 9.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 162.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.34 29.43 63.21 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.197 -0.94 . . . . 0.0 113.332 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -128.54 154.79 45.78 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 128.173 2.589 . . . . 0.0 110.93 -175.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.4 HD22 ' CE1' ' A' ' 87' ' ' PHE . 0.1 OUTLIER -114.48 99.52 7.62 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 178.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -100.85 153.22 19.67 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 -175.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.472 ' CE1' HD12 ' A' ' 112' ' ' LEU . 37.9 m-85 -115.52 161.68 18.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.008 0.909 . . . . 0.0 110.087 -171.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.51 -168.09 37.9 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 108.693 -1.763 . . . . 0.0 108.693 159.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.85 149.97 34.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 165.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.8 mt -126.16 171.73 10.63 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.574 1.55 . . . . 0.0 110.568 -170.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.78 175.99 37.42 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 124.034 0.826 . . . . 0.0 111.081 164.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -159.43 -115.77 0.42 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.0 t -115.12 -175.1 2.62 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 129.793 3.237 . . . . 0.0 109.872 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.2 mmt180 -141.98 56.05 1.48 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.465 1.906 . . . . 0.0 108.337 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.97 159.01 31.53 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.265 -0.897 . . . . 0.0 109.753 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.9 112.18 23.84 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.989 1.316 . . . . 0.0 110.305 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.1 m -117.49 -9.34 10.86 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -176.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 55.7 mtm 61.03 22.37 12.63 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.148 0.979 . . . . 0.0 112.844 171.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.3 p -114.18 154.43 46.24 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 126.303 1.841 . . . . 0.0 108.988 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.57 -40.95 21.31 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 120.891 1.061 . . . . 0.0 109.522 170.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -70.54 -5.62 56.25 Favored Glycine 0 C--O 1.22 -0.742 0 CA-C-O 116.824 -2.098 . . . . 0.0 113.841 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . 0.401 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -78.25 -57.88 3.3 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 120.933 2.367 . . . . 0.0 109.784 168.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.36 -15.88 63.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.05 0.94 . . . . 0.0 111.846 -167.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.53 -6.13 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.716 0.806 . . . . 0.0 111.68 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -44.26 -52.57 7.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.706 1.139 . . . . 0.0 110.44 165.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -60.77 -46.36 94.65 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 119.934 -0.37 . . . . 0.0 112.498 -173.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.47 85.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.188 0.494 . . . . 0.0 109.81 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -68.64 -47.06 67.55 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.228 -0.92 . . . . 0.0 111.016 -173.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.01 -29.32 68.4 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.763 0.71 . . . . 0.0 111.017 173.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -42.02 90.91 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.084 0.554 . . . . 0.0 111.293 171.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.35 65.22 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.651 0.78 . . . . 0.0 112.111 -173.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 87' ' ' PHE . 1.1 mm? -71.83 -12.52 61.32 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.781 169.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 12.1 p -93.78 13.96 20.79 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.547 1.521 . . . . 0.0 112.311 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -141.11 28.72 1.87 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.53 1.059 . . . . 0.0 111.804 -171.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.9 mm -71.56 80.57 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 125.441 1.497 . . . . 0.0 107.447 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -80.27 -34.67 36.84 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 165.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -125.4 164.04 21.29 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.101 0.96 . . . . 0.0 110.576 -176.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 53.7 m -160.87 145.28 13.82 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.04 91.78 0.15 Allowed Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 108.229 -1.949 . . . . 0.0 108.229 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.483 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.266 4.5 p -87.59 132.46 32.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.389 1.094 . . . . 0.0 110.091 165.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -98.42 88.52 4.15 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 166.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 51.8 tpp -82.67 57.48 3.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 174.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -145.08 116.51 8.04 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.27 125.48 14.97 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-O 117.297 -1.335 . . . . 0.0 109.517 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 115.2 3.41 Favored 'Cis proline' 0 CA--C 1.538 0.691 0 O-C-N 122.933 0.965 . . . . 0.0 112.706 5.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -78.82 129.71 34.89 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -167.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.67 160.29 41.44 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.443 1.497 . . . . 0.0 108.424 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 46.6 ttp -134.09 127.11 31.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -123.61 109.72 14.11 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.813 0.845 . . . . 0.0 108.737 -174.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 16.3 mt -94.04 143.49 26.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -131.85 136.29 57.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.2 mp -95.33 171.27 8.81 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.625 0.726 . . . . 0.0 110.497 -174.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -53.31 -27.47 23.3 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 112.621 168.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -90.66 -16.56 28.38 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.193 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 105.99 8.35 34.25 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.693 -1.615 . . . . 0.0 115.607 177.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.18 165.45 0.09 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 120.063 1.931 . . . . 0.0 110.842 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.3 m -142.11 95.86 2.87 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 120.243 -1.536 . . . . 0.0 109.67 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.0 mp -86.92 146.72 26.06 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.156 -0.965 . . . . 0.0 108.68 173.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.4 m -125.46 125.23 43.0 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.94 1.296 . . . . 0.0 109.038 -176.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -123.07 135.01 54.23 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.322 1.049 . . . . 0.0 110.084 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -81.54 147.51 29.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.912 1.285 . . . . 0.0 108.338 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.8 tpt85 -76.26 100.42 5.08 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.694 -1.254 . . . . 0.0 108.94 165.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 20.7 t -75.76 127.65 33.48 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 146.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -131.47 17.2 4.88 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.455 1.902 . . . . 0.0 112.853 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 . . . . . 0 C--O 1.251 1.181 0 CA-C-N 118.872 0.76 . . . . 0.0 110.065 170.145 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.2 144.27 31.87 Favored Pre-proline 0 N--CA 1.472 0.66 0 C-N-CA 124.533 1.133 . . . . 0.0 111.158 -174.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -84.8 -18.51 4.47 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 124.215 3.277 . . . . 0.0 112.577 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.81 -10.36 8.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.992 0.917 . . . . 0.0 113.022 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -101.38 -2.37 31.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.409 2.284 . . . . 0.0 112.611 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.1 m -60.69 -57.21 13.67 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.098 1.317 . . . . 0.0 111.598 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.478 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -50.68 -18.14 0.65 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 178.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -80.78 5.25 16.42 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.125 1.37 . . . . 0.0 111.262 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.6 61.71 3.74 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 119.546 -1.971 . . . . 0.0 111.575 -173.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.24 -52.35 1.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 118.764 0.711 . . . . 0.0 112.646 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.0 -4.79 57.24 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.919 0.781 . . . . 0.0 111.79 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.5 -177.1 2.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.487 1.115 . . . . 0.0 111.499 -173.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.3 m -142.95 -57.73 0.43 Allowed 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.082 -1.636 . . . . 0.0 112.845 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 9.0 m95 69.83 165.68 0.27 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.342 1.857 . . . . 0.0 112.293 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -143.14 137.69 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -79.5 132.06 36.22 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 175.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.3 t -126.24 -17.05 5.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.38 158.35 34.08 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.653 1.115 . . . . 0.0 111.097 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -139.06 95.04 2.88 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.737 1.615 . . . . 0.0 108.672 -176.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.95 146.16 46.25 Favored 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 121.441 -0.787 . . . . 0.0 110.439 174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 41' ' ' ARG . 28.3 mt-30 -80.23 166.49 21.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.096 1.358 . . . . 0.0 109.645 166.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.29 14.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.84 2.056 . . . . 0.0 113.497 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -137.13 4.61 2.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.154 1.782 . . . . 0.0 111.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.94 -5.0 78.93 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.357 -1.464 . . . . 0.0 112.961 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.3 m -68.94 108.41 3.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.659 1.584 . . . . 0.0 108.971 171.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.74 129.82 41.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.007 -1.058 . . . . 0.0 109.957 163.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 35' ' ' GLN . 28.3 mtt85 -77.86 172.69 13.08 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.827 1.651 . . . . 0.0 110.71 174.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.42 136.18 33.96 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 162.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.71 157.59 77.94 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.289 1.836 . . . . 0.0 108.486 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.86 123.9 9.72 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.753 1.635 . . . . 0.0 109.739 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -78.51 172.05 14.22 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 164.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -51.65 62.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.095 0.958 . . . . 0.0 111.911 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -67.31 -14.42 62.9 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -68.96 -15.75 63.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.749 1.159 . . . . 0.0 110.884 174.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.94 -30.76 3.65 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 123.343 0.497 . . . . 0.0 112.876 160.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.65 85.13 4.91 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -174.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -73.76 160.81 43.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.999 2.466 . . . . 0.0 112.708 -176.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.474 HG12 ' H ' ' A' ' 70' ' ' GLY . 16.5 mt -85.7 101.05 9.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.479 1.111 . . . . 0.0 108.772 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -121.54 119.16 31.14 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -79.31 164.94 23.68 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 175.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.2 m -149.82 111.71 4.57 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 119.918 -1.739 . . . . 0.0 108.34 167.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.13 147.22 29.17 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 164.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.6 t -165.4 158.22 15.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.8 p -130.88 29.36 4.74 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.567 -0.708 . . . . 0.0 110.089 167.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -53.76 -44.96 70.44 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.01 0.924 . . . . 0.0 112.018 -170.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -14.09 62.77 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.623 0.769 . . . . 0.0 112.623 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.2 2.26 55.81 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 125.497 1.522 . . . . 0.0 112.902 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.0 174.48 6.18 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.492 1.646 . . . . 0.0 108.967 164.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 26.8 mtp85 -82.21 63.07 6.23 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 125.871 1.668 . . . . 0.0 109.176 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.35 157.99 30.35 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 162.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.31 156.32 43.23 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 149.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 p -126.84 171.72 11.01 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 166.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.97 178.71 44.11 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.339 -1.504 . . . . 0.0 109.339 168.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -111.87 129.73 56.06 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 p -130.21 118.52 21.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.328 1.451 . . . . 0.0 109.3 -176.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.474 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 57.45 -78.83 0.01 OUTLIER Glycine 0 CA--C 1.526 0.778 0 C-N-CA 126.826 2.155 . . . . 0.0 112.052 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.0 OUTLIER -138.67 0.32 2.01 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 170.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -117.13 139.11 51.15 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 119.867 1.212 . . . . 0.0 109.587 175.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -70.75 154.93 41.39 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.57 -0.452 . . . . 0.0 109.889 161.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -138.15 164.96 27.85 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.399 1.479 . . . . 0.0 109.393 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -156.0 163.97 39.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.522 1.529 . . . . 0.0 108.469 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.56 -174.76 34.3 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 125.479 1.514 . . . . 0.0 109.331 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 p -84.14 159.57 21.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.587 0.694 . . . . 0.0 112.106 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 6.7 p90 -139.75 165.18 27.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 168.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.34 153.23 39.43 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.934 1.294 . . . . 0.0 110.78 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.6 mt -126.09 96.69 4.82 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 125.517 1.527 . . . . 0.0 109.62 -168.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -159.81 171.61 19.17 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -171.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 56.52 23.3 7.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.29 1.436 . . . . 0.0 113.948 171.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.46 25.18 68.39 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.048 -1.032 . . . . 0.0 111.54 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -144.87 161.63 38.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.428 1.114 . . . . 0.0 111.422 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.4 tp -78.86 157.19 28.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.8 p -148.96 159.07 44.54 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 120.553 -1.342 . . . . 0.0 108.509 164.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 95.8 m-85 -133.03 165.27 25.14 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.578 1.151 . . . . 0.0 109.211 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -102.72 -156.2 25.37 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 173.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.9 t -56.76 95.04 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.355 1.062 . . . . 0.0 110.234 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mt -84.1 156.56 22.1 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.312 2.245 . . . . 0.0 109.66 167.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -171.14 166.81 39.96 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 165.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -162.62 -174.78 32.94 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 108.305 -1.918 . . . . 0.0 108.305 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.08 173.89 7.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.644 0.735 . . . . 0.0 110.61 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -125.39 73.1 1.29 Allowed 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.276 1.431 . . . . 0.0 107.221 172.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 64.4 mtm -72.71 162.02 30.01 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.862 1.665 . . . . 0.0 109.01 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -106.55 133.43 51.25 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.286 1.034 . . . . 0.0 109.482 174.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 51.0 m -126.97 -9.35 6.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.107 0.963 . . . . 0.0 113.286 166.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.3 ptp 44.69 48.41 8.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.66 1.584 . . . . 0.0 113.123 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.3 p -135.68 156.45 77.49 Favored Pre-proline 0 C--O 1.239 0.537 0 C-N-CA 124.785 1.234 . . . . 0.0 110.372 177.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.95 -25.09 20.12 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.972 2.448 . . . . 0.0 111.85 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.95 -19.36 70.33 Favored Glycine 0 C--N 1.34 0.777 0 CA-C-O 118.439 -1.201 . . . . 0.0 111.561 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.46 -63.5 2.61 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-N 119.492 1.646 . . . . 0.0 110.326 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.42 -3.42 30.42 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -165.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.9 -18.14 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 O-C-N 121.725 -0.609 . . . . 0.0 111.673 167.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -46.53 -48.86 19.25 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.714 1.606 . . . . 0.0 111.302 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -54.34 -42.3 73.85 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.217 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.08 -37.12 61.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.989 0.895 . . . . 0.0 109.194 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.77 -44.83 96.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.192 0.597 . . . . 0.0 110.792 -174.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.72 -40.85 96.53 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.034 0.379 . . . . 0.0 109.983 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -17.66 64.66 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.58 0.752 . . . . 0.0 112.573 177.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.38 2.8 37.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.32 2.248 . . . . 0.0 112.281 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.0 mt -93.5 -26.89 16.97 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.116 1.325 . . . . 0.0 112.514 176.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.16 -11.04 42.3 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.794 1.179 . . . . 0.0 112.552 -178.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -96.98 106.51 18.86 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 168.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -136.02 65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 104.834 -2.284 . . . . 0.0 104.834 172.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.2 -33.76 73.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 116.276 -1.821 . . . . 0.0 109.93 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.722 ' HB2' ' CG1' ' A' ' 131' ' ' VAL . 74.5 mtt-85 -129.03 172.63 11.19 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-N 121.803 2.092 . . . . 0.0 112.981 162.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 m -150.44 150.93 31.99 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.822 1.649 . . . . 0.0 106.734 175.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -136.3 106.47 0.56 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 172.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -86.54 108.67 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 172.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 73.05 3.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 168.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttm -73.71 74.67 1.55 Allowed 'General case' 0 C--N 1.341 0.225 0 CA-C-O 122.717 1.246 . . . . 0.0 107.92 171.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -148.26 112.8 5.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 102.308 -3.219 . . . . 0.0 102.308 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.59 134.99 95.4 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-O 116.907 -1.521 . . . . 0.0 108.0 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -76.09 123.36 9.26 Favored 'Cis proline' 0 N--CA 1.451 -1.018 0 CA-C-N 120.847 1.338 . . . . 0.0 109.978 -2.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -61.72 149.57 39.32 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.297 1.046 . . . . 0.0 111.232 -173.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.54 163.69 31.34 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 126.487 1.915 . . . . 0.0 106.159 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.92 167.49 16.55 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 122.733 1.254 . . . . 0.0 109.098 173.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -148.45 135.4 20.06 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -130.59 153.77 48.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.722 ' CG1' ' HB2' ' A' ' 117' ' ' ARG . 2.6 p -138.45 158.43 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 119.854 -0.739 . . . . 0.0 111.812 175.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 136' ' ' ASP . 2.2 mp -103.64 158.22 16.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 122.5 1.143 . . . . 0.0 108.944 175.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -21.12 66.48 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 126.273 1.829 . . . . 0.0 110.841 -166.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -71.81 -35.62 70.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 128.351 2.66 . . . . 0.0 111.065 171.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 126.83 -2.97 7.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 126.485 1.993 . . . . 0.0 113.463 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.447 ' HB2' HD22 ' A' ' 132' ' ' LEU . 66.1 m-20 -68.01 110.46 3.93 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.193 -1.181 . . . . 0.0 108.363 -177.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 28.4 m -108.64 106.78 16.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.705 1.602 . . . . 0.0 109.483 -168.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.59 160.41 22.52 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.616 -1.303 . . . . 0.0 109.645 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 61.6 m -137.78 128.86 27.45 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.289 -1.507 . . . . 0.0 109.374 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -118.28 146.28 44.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.604 -175.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -88.19 151.85 22.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 166.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -66.77 135.41 53.93 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 159.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -136.49 113.97 10.92 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.756 -2.683 . . . . 0.0 103.756 158.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.9 p -126.21 12.95 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.321 1.448 . . . . 0.0 111.356 173.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 C-N-CA 123.851 0.86 . . . . 0.0 111.622 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -127.86 147.85 64.7 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 123.87 0.868 . . . . 0.0 112.423 -167.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.49 -26.41 34.33 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 124.132 3.221 . . . . 0.0 112.09 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.06 -18.7 3.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.95 1.7 . . . . 0.0 112.587 173.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -120.09 18.81 12.36 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.615 1.966 . . . . 0.0 111.016 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 84' ' ' LYS . 14.7 m -112.24 -14.2 13.38 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.307 0.958 . . . . 0.0 112.62 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -10.09 59.15 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 120.569 -1.332 . . . . 0.0 113.076 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.41 16.32 20.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.06 0.944 . . . . 0.0 109.214 -175.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.66 14.37 3.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.145 1.778 . . . . 0.0 113.75 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -76.0 -39.05 56.62 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 120.917 1.69 . . . . 0.0 112.033 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.63 -0.91 9.08 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -162.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.2 p -95.32 166.88 11.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.309 1.044 . . . . 0.0 111.642 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.7 m -144.96 149.2 34.8 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.787 1.635 . . . . 0.0 109.515 -169.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.439 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 69.1 m95 -157.93 172.88 17.66 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.781 1.232 . . . . 0.0 112.137 -150.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.8 p -157.02 119.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 177.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 138' ' ' LEU . 16.0 tp -60.71 127.86 33.75 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.53 -11.87 3.5 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 123.847 0.717 . . . . 0.0 111.527 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.52 151.28 32.43 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 119.607 1.094 . . . . 0.0 110.579 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -138.73 112.49 8.38 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.42 139.95 31.78 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 173.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -70.04 171.17 9.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 160.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.5 84.17 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.203 -0.311 . . . . 0.0 110.664 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 0.9 44.96 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.072 0.949 . . . . 0.0 111.601 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.67 -2.69 49.2 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-O 118.816 -0.991 . . . . 0.0 113.208 168.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 m -61.16 103.81 0.32 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.061 1.344 . . . . 0.0 108.818 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 119.01 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 120.779 -1.201 . . . . 0.0 109.684 169.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -73.24 155.43 39.55 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.092 0.957 . . . . 0.0 109.469 170.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.99 141.35 43.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.421 163.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -138.96 158.59 69.49 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 125.638 1.575 . . . . 0.0 108.24 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.4 109.0 1.92 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.07 1.846 . . . . 0.0 109.706 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.13 173.9 1.77 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.022 0.929 . . . . 0.0 110.5 174.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.11 12.08 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.263 -0.898 . . . . 0.0 110.37 170.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -71.61 -6.56 41.77 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -67.96 -13.45 62.18 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.867 1.212 . . . . 0.0 112.274 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 127.3 -72.66 0.46 Allowed Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.732 1.151 . . . . 0.0 112.131 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.69 85.21 21.24 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 126.101 1.761 . . . . 0.0 109.691 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.01 163.77 37.4 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.346 2.697 . . . . 0.0 112.754 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 16.3 mt -87.16 87.84 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.332 1.053 . . . . 0.0 108.741 177.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.27 130.14 54.18 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -174.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.2 tp -114.39 139.29 49.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.848 1.659 . . . . 0.0 106.942 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 m -125.81 137.73 53.79 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 168.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.5 128.47 56.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 167.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -169.74 177.29 4.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 40.8 p -93.27 47.74 1.28 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 109.647 164.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -61.63 -51.96 66.34 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.069 -1.02 . . . . 0.0 110.03 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.416 HG23 ' H ' ' A' ' 62' ' ' GLN . 8.7 t -71.38 -25.23 62.27 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.794 -0.566 . . . . 0.0 111.069 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.33 0.01 29.6 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.471 1.51 . . . . 0.0 113.848 -167.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.416 ' H ' HG23 ' A' ' 60' ' ' THR . 8.8 mt-30 -118.14 154.92 31.33 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.907 1.683 . . . . 0.0 108.415 166.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -76.99 78.0 3.54 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.677 1.191 . . . . 0.0 109.809 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -130.45 163.85 26.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.487 1.136 . . . . 0.0 113.939 -173.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.02 100.42 10.01 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 125.89 1.676 . . . . 0.0 106.823 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -108.33 63.69 0.61 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.592 1.187 . . . . 0.0 111.446 -177.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -110.21 169.14 13.37 Favored Glycine 0 N--CA 1.467 0.763 0 C-N-CA 125.146 1.355 . . . . 0.0 111.324 -163.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.529 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.6 t80 -95.03 129.9 41.92 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.6 t -108.16 175.09 5.6 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 163.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.84 -29.77 2.14 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 127.36 2.41 . . . . 0.0 116.639 -156.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.5 t -135.65 -27.03 1.19 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 118.757 1.278 . . . . 0.0 112.716 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.09 137.58 51.33 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.1 ptt180 -65.67 -174.74 0.23 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.82 -1.536 . . . . 0.0 110.43 170.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -149.91 168.48 23.66 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 124.103 0.961 . . . . 0.0 109.218 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -153.83 153.85 32.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 126.981 2.112 . . . . 0.0 105.965 167.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -164.59 -113.21 0.28 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.498 -1.841 . . . . 0.0 108.498 164.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.82 168.25 20.67 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 126.745 2.018 . . . . 0.0 106.951 157.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -118.43 -179.23 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.719 1.208 . . . . 0.0 108.848 165.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -164.41 116.88 1.32 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.332 0.969 . . . . 0.0 111.256 172.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.04 113.37 12.28 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.133 0.973 . . . . 0.0 109.203 -174.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -148.65 168.53 22.59 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.799 1.24 . . . . 0.0 108.116 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 t0 48.43 23.08 0.54 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.005 2.122 . . . . 0.0 116.064 172.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.442 ' O ' HG21 ' A' ' 118' ' ' THR . . . 67.53 20.49 71.87 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-O 117.136 -1.925 . . . . 0.0 111.976 -172.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.429 ' HA ' HG21 ' A' ' 20' ' ' THR . 0.4 OUTLIER -128.11 170.73 12.61 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 128.074 2.55 . . . . 0.0 111.572 -176.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.6 99.58 7.84 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -97.92 157.56 16.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -122.2 175.76 6.21 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.075 1.35 . . . . 0.0 110.379 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.25 -162.75 18.84 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 126.078 1.799 . . . . 0.0 109.483 172.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.2 t -59.01 115.13 2.94 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 163.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.03 155.78 18.39 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.889 1.275 . . . . 0.0 109.127 176.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.87 157.86 12.87 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 163.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.51 91.89 0.1 OUTLIER Glycine 0 CA--C 1.523 0.58 0 CA-C-N 119.187 1.493 . . . . 0.0 114.884 172.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 82.4 p 63.72 175.33 0.17 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 131.508 3.923 . . . . 0.0 112.004 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -137.86 53.4 1.84 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.921 1.689 . . . . 0.0 109.107 -176.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.2 mtm -61.62 170.74 1.79 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.184 0.994 . . . . 0.0 110.425 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.03 128.92 54.82 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.687 1.195 . . . . 0.0 110.414 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 74.3 m -134.28 101.47 5.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 126.446 1.898 . . . . 0.0 106.553 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 22.9 ptp -70.64 44.78 0.08 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.025 1.73 . . . . 0.0 113.22 -177.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.4 p -129.02 161.7 56.51 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 125.855 1.662 . . . . 0.0 107.801 -169.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.06 -47.53 6.36 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.165 1.91 . . . . 0.0 110.085 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.43 -1.76 66.13 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.775 -1.014 . . . . 0.0 112.361 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.95 -42.07 6.1 Favored Glycine 0 C--N 1.336 0.559 0 CA-C-N 118.849 1.324 . . . . 0.0 110.547 175.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.34 -16.34 40.3 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.213 1.006 . . . . 0.0 112.818 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.91 -15.34 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.771 0.829 . . . . 0.0 112.44 173.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -44.75 -47.51 10.78 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 125.604 1.561 . . . . 0.0 110.093 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -53.36 -47.61 61.87 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 119.579 -0.567 . . . . 0.0 111.785 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.97 74.43 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.682 0.741 . . . . 0.0 110.876 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.86 -42.71 90.06 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.7 -0.625 . . . . 0.0 110.216 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.24 -14.3 62.78 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.751 -1.218 . . . . 0.0 112.016 173.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.45 -8.32 45.01 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 169.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.92 -37.31 13.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.4 mt -72.93 -4.83 34.57 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.708 -1.245 . . . . 0.0 112.067 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 76.9 p -78.08 -8.47 58.26 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.674 1.189 . . . . 0.0 111.54 168.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -122.2 71.46 1.01 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.549 1.94 . . . . 0.0 107.633 -174.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.8 mm -107.95 66.2 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -73.8 -42.27 61.21 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 116.624 -2.03 . . . . 0.0 110.334 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -121.72 172.82 7.86 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.009 1.724 . . . . 0.0 110.578 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.442 HG21 ' O ' ' A' ' 83' ' ' GLY . 11.4 t -168.52 172.34 8.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -168.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 174.57 103.13 0.16 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 171.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 67.8 t -88.13 150.92 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 120.506 -1.585 . . . . 0.0 109.641 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.26 93.13 4.34 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.7 ttm -91.58 54.28 2.46 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 123.219 1.485 . . . . 0.0 110.052 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -135.55 126.11 26.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.245 -2.502 . . . . 0.0 104.245 170.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.82 128.6 93.81 Favored Pre-proline 0 N--CA 1.446 -0.659 0 CA-C-O 117.103 -1.427 . . . . 0.0 107.151 171.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.39 114.67 3.2 Favored 'Cis proline' 0 CA--C 1.539 0.749 0 O-C-N 123.531 1.279 . . . . 0.0 114.099 5.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.95 137.55 41.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.811 0.845 . . . . 0.0 110.778 -170.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -146.77 161.89 39.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.202 1.801 . . . . 0.0 108.0 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.33 148.66 27.78 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 171.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -129.42 133.58 47.41 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.311 0.577 . . . . 0.0 109.723 159.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.2 mt -117.65 148.5 41.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.775 1.23 . . . . 0.0 109.638 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.8 t -130.95 123.25 53.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -171.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 12.0 mt -71.64 166.93 20.87 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.64 -21.79 41.77 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.135 1.374 . . . . 0.0 111.259 173.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -80.97 -23.65 38.63 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 126.366 1.866 . . . . 0.0 111.72 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.74 -1.57 56.84 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 124.303 0.954 . . . . 0.0 113.448 -170.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.14 146.35 15.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.406 1.482 . . . . 0.0 108.623 170.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.4 m -135.56 102.84 5.24 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.63 1.172 . . . . 0.0 109.15 -163.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 30' ' ' LEU . 7.1 mp -93.5 128.05 39.44 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.402 -1.436 . . . . 0.0 109.167 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 32.2 m -107.68 131.92 53.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.533 1.133 . . . . 0.0 108.154 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -127.28 153.79 45.7 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.996 0.919 . . . . 0.0 110.625 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.587 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -86.36 156.31 20.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 117.489 -1.243 . . . . 0.0 108.553 -175.424 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -85.88 95.35 9.43 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.987 1.721 . . . . 0.0 107.453 162.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -92.0 76.33 5.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 6.4 t -82.24 13.2 3.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 115.736 -2.078 . . . . 0.0 110.897 -172.408 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 CA--C 1.538 0.482 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.522 HD22 ' HB3' ' A' ' 18' ' ' ALA . 3.2 t30 -84.92 144.36 41.67 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 118.231 0.469 . . . . 0.0 112.065 -173.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.97 -23.28 30.03 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.761 2.308 . . . . 0.0 112.03 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.522 ' HB3' HD22 ' A' ' 16' ' ' ASN . . . -63.73 -1.73 1.46 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.405 1.882 . . . . 0.0 114.345 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.02 3.99 14.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.48 1.512 . . . . 0.0 112.004 -178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.535 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.3 t -74.86 -12.24 60.33 Favored 'General case' 0 CA--C 1.556 1.183 0 O-C-N 121.447 -0.783 . . . . 0.0 111.119 -175.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -8.37 34.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 118.992 -2.318 . . . . 0.0 112.641 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.2 mt -105.9 21.08 17.9 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.337 1.055 . . . . 0.0 112.391 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.535 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.1 mm? -110.08 62.5 0.6 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.264 1.826 . . . . 0.0 109.169 -175.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 p-10 -137.29 -41.03 0.57 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 123.689 0.796 . . . . 0.0 112.129 -163.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -136.41 16.76 3.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.354 1.073 . . . . 0.0 110.897 -177.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.7 170.24 8.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.191 2.997 . . . . 0.0 109.114 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.3 m -152.18 148.27 27.41 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 119.295 -2.128 . . . . 0.0 110.096 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 28.0 m95 -148.78 175.3 11.35 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.067 1.347 . . . . 0.0 110.221 -162.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.9 t -146.29 127.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.82 133.1 47.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 t -133.56 -9.92 2.81 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.591 ' HB3' ' HB ' ' A' ' 139' ' ' THR . . . -154.41 140.78 18.69 Favored 'General case' 0 C--N 1.339 0.143 0 O-C-N 120.629 -1.295 . . . . 0.0 109.351 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -135.28 98.76 4.05 Favored 'General case' 0 C--N 1.334 -0.106 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.82 136.61 34.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 120.447 -1.408 . . . . 0.0 107.312 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -66.97 163.83 18.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 157.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.57 84.47 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.247 0.546 . . . . 0.0 111.033 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -12.63 59.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 122.776 0.43 . . . . 0.0 110.427 -175.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 119.46 -4.59 13.38 Favored Glycine 0 C--N 1.34 0.798 0 CA-C-O 118.317 -1.268 . . . . 0.0 114.276 169.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -73.22 107.75 5.72 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.894 1.847 . . . . 0.0 108.84 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.51 110.3 1.64 Allowed 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.631 0.772 . . . . 0.0 109.89 166.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -62.0 154.42 26.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.498 1.519 . . . . 0.0 110.308 172.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.66 132.61 47.82 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 m -138.87 156.35 72.73 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 124.402 1.081 . . . . 0.0 109.876 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.15 108.69 2.21 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.45 2.1 . . . . 0.0 110.249 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 168.78 12.96 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.091 0.956 . . . . 0.0 111.033 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.26 -7.95 46.33 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.369 1.468 . . . . 0.0 112.836 170.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -118.51 9.92 12.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.304 2.242 . . . . 0.0 111.078 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -98.63 -10.35 23.44 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.298 -0.876 . . . . 0.0 112.346 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.59 -45.0 1.19 Allowed Glycine 0 C--N 1.335 0.509 0 C-N-CA 123.847 0.736 . . . . 0.0 114.312 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.87 79.53 27.33 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 127.032 2.133 . . . . 0.0 109.8 -170.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -66.22 158.41 54.97 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 123.135 2.557 . . . . 0.0 111.231 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.1 mt -90.22 113.54 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 C-N-CA 124.341 1.056 . . . . 0.0 108.229 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.9 p -119.06 140.72 49.58 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 -171.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.1 tp -125.5 140.48 52.73 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.13 1.372 . . . . 0.0 108.791 -177.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 20.7 m -134.8 129.35 34.41 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.707 1.603 . . . . 0.0 107.208 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 56' ' ' LEU . 1.8 mm? -118.75 122.95 43.66 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 178.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -168.63 -153.12 0.12 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.8 p -122.46 46.86 2.04 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.266 1.026 . . . . 0.0 112.545 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.22 -46.85 88.33 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.571 -1.331 . . . . 0.0 111.851 -173.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -77.89 1.39 20.67 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.07 -1.644 . . . . 0.0 112.342 173.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.78 -9.86 74.66 Favored Glycine 0 CA--C 1.526 0.736 0 O-C-N 120.079 -1.638 . . . . 0.0 113.119 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -104.6 160.38 14.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 119.47 1.635 . . . . 0.0 108.962 164.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -64.33 91.27 0.07 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.839 0.856 . . . . 0.0 109.604 171.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -133.74 155.28 50.04 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.603 0.716 . . . . 0.0 110.021 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.79 146.78 26.62 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.62 151.95 45.81 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 154.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.45 177.92 48.06 Favored Glycine 0 N--CA 1.445 -0.763 0 O-C-N 121.222 -0.923 . . . . 0.0 112.227 -174.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -125.13 105.57 9.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.69 1.196 . . . . 0.0 107.994 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -85.03 -1.35 56.72 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 125.083 1.353 . . . . 0.0 113.915 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 149.48 -74.71 0.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 109.374 -1.49 . . . . 0.0 109.374 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 18.0 t -151.05 14.78 0.72 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 1.157 . . . . 0.0 113.386 177.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.08 -6.01 10.47 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.081 -1.637 . . . . 0.0 112.327 172.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 52.65 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.515 1.526 . . . . 0.0 111.441 -162.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -151.72 153.28 34.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.558 167.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -145.41 161.25 40.13 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.692 1.997 . . . . 0.0 107.19 170.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.46 163.43 11.6 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 171.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 20.3 m -69.59 163.91 24.45 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.935 0.894 . . . . 0.0 111.329 -170.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -137.93 171.94 13.68 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.53 0.732 . . . . 0.0 111.598 172.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.06 150.38 31.65 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.881 1.672 . . . . 0.0 108.024 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 70.1 mt -117.63 117.36 29.17 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -164.44 168.4 18.5 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.753 1.221 . . . . 0.0 109.285 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.0 t0 48.19 23.4 0.53 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.04 77.88 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 120.085 -1.634 . . . . 0.0 113.148 -175.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' A' ' 115' ' ' ILE . 25.1 pttt -141.37 140.9 33.8 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.065 1.933 . . . . 0.0 112.164 -174.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.552 ' O ' HG21 ' A' ' 115' ' ' ILE . 14.8 tp -82.88 105.15 13.65 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.852 1.661 . . . . 0.0 108.697 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.9 m -106.88 159.05 16.55 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.789 0.804 . . . . 0.0 109.534 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.486 ' HB3' HD21 ' A' ' 90' ' ' LEU . 73.3 m-85 -115.59 -165.92 1.08 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.69 1.196 . . . . 0.0 110.435 -167.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.37 -87.77 1.7 Allowed Glycine 0 C--N 1.334 0.433 0 O-C-N 120.717 -1.24 . . . . 0.0 110.085 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.8 m -154.69 69.22 0.74 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.696 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -61.92 164.2 6.76 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 120.923 -1.111 . . . . 0.0 112.494 -173.219 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -177.3 -179.98 47.83 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 169.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.13 -158.25 7.57 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.505 1.05 . . . . 0.0 111.642 -171.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 58.7 p -88.32 178.98 6.43 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 166.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -128.28 59.16 1.52 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.306 1.412 . . . . 0.0 110.724 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.9 mtm -59.19 165.06 2.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.493 161.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.93 153.33 24.66 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -134.71 159.64 40.65 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 123.629 0.771 . . . . 0.0 109.741 169.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -111.61 19.54 18.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 124.818 1.247 . . . . 0.0 110.772 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.4 p -96.49 165.09 16.8 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.125 1.77 . . . . 0.0 108.133 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.77 -42.06 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.261 1.974 . . . . 0.0 109.572 165.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.47 7.31 48.25 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-O 118.319 -1.267 . . . . 0.0 112.927 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.82 -55.84 2.08 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 108.136 -1.986 . . . . 0.0 108.136 170.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -60.47 -27.03 67.23 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.871 0.868 . . . . 0.0 112.487 -174.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -63.63 -17.91 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.581 0.752 . . . . 0.0 112.3 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.04 -40.91 64.27 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 119.364 0.984 . . . . 0.0 110.404 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.57 -28.18 72.07 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.088 -0.84 . . . . 0.0 111.973 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -80.42 -45.41 17.69 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.355 1.077 . . . . 0.0 110.031 171.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.14 -46.6 86.47 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 111.115 -171.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.54 -47.46 69.97 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 118.422 0.556 . . . . 0.0 109.549 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.57 -32.49 74.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.044 0.538 . . . . 0.0 111.735 -177.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.21 -26.49 68.15 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.303 0.641 . . . . 0.0 111.357 174.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 77.4 mt -69.02 -12.11 61.39 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.997 0.817 . . . . 0.0 112.25 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.3 p -91.3 -4.57 55.74 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.327 0.967 . . . . 0.0 111.806 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -117.82 71.52 0.82 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.552 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.9 mm -107.62 83.13 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 106.201 -1.778 . . . . 0.0 106.201 172.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -95.91 -28.87 14.48 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 119.365 -0.934 . . . . 0.0 112.257 166.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -130.16 166.54 20.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 122.493 1.14 . . . . 0.0 110.303 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.9 m -162.81 170.02 18.94 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 -177.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.44 143.04 10.18 Favored Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 105.319 -3.113 . . . . 0.0 105.319 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.6 t -129.47 128.52 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 174.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.01 88.82 2.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 -174.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 50.39 0.61 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.854 1.788 . . . . 0.0 111.659 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.24 128.39 48.22 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.219 2.607 . . . . 0.0 104.358 170.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.22 136.3 80.97 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-O 117.204 -1.379 . . . . 0.0 107.684 147.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -72.67 121.89 7.01 Favored 'Cis proline' 0 N--CA 1.456 -0.703 0 CA-C-N 120.341 1.157 . . . . 0.0 110.825 -8.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.68 138.9 41.63 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.622 0.725 . . . . 0.0 110.884 -171.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -146.27 153.76 40.94 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 171.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 44.8 ttp -116.36 145.31 43.31 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.491 1.516 . . . . 0.0 107.675 176.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -133.65 102.81 5.62 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.384 0.993 . . . . 0.0 110.868 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 73.3 mt -80.62 148.88 30.08 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 66.0 t -131.72 128.47 60.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 11.2 mt -81.49 156.49 25.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.75 -36.19 35.35 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.731 1.612 . . . . 0.0 112.454 177.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.75 -6.26 58.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.075 1.35 . . . . 0.0 111.27 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.96 -4.22 14.18 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.93 1.729 . . . . 0.0 114.897 157.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.28 156.83 7.02 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 109.845 -178.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 27.2 m -140.0 97.76 3.31 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.299 -0.876 . . . . 0.0 109.548 -172.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.36 142.58 30.93 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.591 ' HB ' ' HB3' ' A' ' 32' ' ' ALA . 35.7 m -127.85 129.6 47.2 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 125.82 1.648 . . . . 0.0 107.676 -173.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.42 121.66 27.8 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.619 1.168 . . . . 0.0 108.714 -167.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.93 144.24 41.18 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -70.57 129.43 39.18 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 172.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 47.8 t -136.13 83.94 2.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.52 19.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.202 1.401 . . . . 0.0 112.425 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 CA-C-O 114.56 -2.638 . . . . 0.0 110.441 -167.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 CA--C 1.535 0.401 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.9 t30 42.03 75.41 0.62 Allowed Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 127.748 2.419 . . . . 0.0 114.25 164.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -60.3 -17.72 48.44 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.178 2.585 . . . . 0.0 114.856 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.18 0.4 9.83 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.742 -1.224 . . . . 0.0 113.631 169.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.58 -26.19 54.8 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.998 1.719 . . . . 0.0 112.184 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.541 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.8 m -62.14 -30.03 70.76 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.324 1.42 . . . . 0.0 111.669 -160.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.54 ' H ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -69.51 -20.14 63.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.039 0.936 . . . . 0.0 113.088 177.422 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.47 -7.58 59.6 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.248 1.019 . . . . 0.0 110.797 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.2 mm? -77.7 5.02 10.14 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.684 -0.635 . . . . 0.0 110.49 173.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -73.1 -20.68 60.9 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 127.433 2.293 . . . . 0.0 112.54 171.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.28 51.38 0.36 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -163.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -153.09 139.13 18.21 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.128 -1.608 . . . . 0.0 109.673 177.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 m -84.5 -64.48 1.15 Allowed 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 -166.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.408 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 15.8 m95 75.5 160.94 0.23 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.948 3.299 . . . . 0.0 115.369 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 53' ' ' THR . 6.0 p -150.19 115.54 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.033 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 138' ' ' LEU . 3.3 tm? -66.81 134.93 53.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.044 0.84 . . . . 0.0 109.456 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.519 ' N ' HD13 ' A' ' 30' ' ' LEU . 3.9 t -144.06 -2.23 0.92 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 174.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -155.12 150.86 27.6 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.462 -1.399 . . . . 0.0 111.455 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.673 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -139.2 132.12 29.36 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.758 2.023 . . . . 0.0 105.988 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.28 135.21 53.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.969 2.107 . . . . 0.0 107.36 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -78.13 170.2 17.01 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.221 0.534 . . . . 0.0 109.583 169.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.06 -15.71 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.07 3.82 44.58 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.756 1.223 . . . . 0.0 110.915 173.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.82 -7.72 81.22 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 124.559 1.076 . . . . 0.0 112.784 175.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 44.5 m -60.94 105.15 0.43 Allowed 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 126.969 2.108 . . . . 0.0 109.883 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.11 111.82 6.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.619 0.767 . . . . 0.0 109.658 170.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.07 155.02 39.77 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.656 0.783 . . . . 0.0 110.751 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.25 141.36 48.94 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 160.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.9 m -143.05 165.9 23.43 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 128.394 2.677 . . . . 0.0 105.63 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -64.42 124.66 13.68 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 CA-C-N 121.478 1.564 . . . . 0.0 108.516 168.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.77 153.86 42.38 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 123.843 0.857 . . . . 0.0 109.96 170.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.78 98.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.961 -0.462 . . . . 0.0 110.751 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.48 2.26 12.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.215 1.006 . . . . 0.0 112.052 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -84.67 -19.09 33.39 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.507 -0.759 . . . . 0.0 111.166 168.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 150.73 -84.14 0.16 Allowed Glycine 0 C--N 1.339 0.709 0 CA-C-N 119.589 1.086 . . . . 0.0 111.703 173.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -120.25 85.23 35.95 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 124.289 1.035 . . . . 0.0 109.945 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.12 175.46 3.19 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.684 2.922 . . . . 0.0 113.178 -178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.488 HG12 ' H ' ' A' ' 70' ' ' GLY . 20.5 mt -85.08 76.82 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 124.928 1.291 . . . . 0.0 109.32 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.482 ' HA ' HG23 ' A' ' 29' ' ' VAL . 0.7 OUTLIER -87.11 127.68 35.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 104.174 -2.528 . . . . 0.0 104.174 -176.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.2 tp -86.59 156.91 19.85 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 172.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -142.3 122.69 13.99 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 168.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 mt -117.89 114.3 23.02 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -164.58 -169.06 1.65 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.038 1.735 . . . . 0.0 108.271 177.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.9 p -130.77 27.7 4.92 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.883 -1.136 . . . . 0.0 114.023 -164.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 t -55.67 -49.02 74.03 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.157 -0.965 . . . . 0.0 112.28 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.3 t -70.5 5.71 1.7 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.773 1.17 . . . . 0.0 112.612 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.52 -5.6 73.0 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 119.765 -1.835 . . . . 0.0 113.692 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -115.49 152.51 32.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 118.976 1.388 . . . . 0.0 111.583 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 ptp85 -70.88 74.35 0.61 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.906 1.682 . . . . 0.0 110.385 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -130.51 147.61 52.22 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.199 -0.938 . . . . 0.0 110.093 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.36 155.39 24.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -158.78 98.73 1.51 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 109.127 159.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -101.25 -158.76 27.16 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 15.4 t80 -126.02 122.41 35.8 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 104.558 -2.386 . . . . 0.0 104.558 174.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.466 ' CB ' ' CZ ' ' A' ' 108' ' ' TYR . 18.7 t -117.15 100.22 7.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.886 2.13 . . . . 0.0 111.315 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.488 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 76.59 -71.99 2.03 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 125.498 1.523 . . . . 0.0 111.855 172.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.8 t -135.62 -2.1 2.46 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.094 1.358 . . . . 0.0 111.353 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.49 108.74 7.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -62.16 159.57 14.48 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 122.466 1.127 . . . . 0.0 110.954 162.438 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -139.64 174.25 10.7 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 112.117 -2.311 . . . . 0.0 108.324 -168.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -159.96 165.6 31.71 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.927 0.891 . . . . 0.0 109.862 173.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 151.96 165.22 12.9 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 124.772 1.177 . . . . 0.0 110.794 164.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 60.6 p -74.12 168.02 20.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.737 0.769 . . . . 0.0 110.778 -163.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -135.51 176.47 8.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.822 0.849 . . . . 0.0 112.304 170.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.48 149.54 30.12 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.326 1.85 . . . . 0.0 107.726 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 23' ' ' LEU . 74.5 mt -128.42 78.67 1.86 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.775 1.23 . . . . 0.0 108.419 -163.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -147.1 168.16 22.29 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.445 1.098 . . . . 0.0 109.512 -169.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.5 t70 56.81 25.07 9.89 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.043 0.937 . . . . 0.0 112.513 169.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.32 -11.39 37.83 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.084 1.802 . . . . 0.0 113.662 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -121.21 137.25 54.76 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.841 2.321 . . . . 0.0 113.311 -163.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 38.4 tp -67.81 107.21 2.53 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 167.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.5 m -100.84 164.73 11.7 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.319 1.048 . . . . 0.0 109.211 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -137.21 147.72 46.02 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.703 0.801 . . . . 0.0 110.909 -175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.01 -154.31 27.27 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.269 1.89 . . . . 0.0 110.611 171.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.5 m -64.18 98.41 0.22 Allowed 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.3 0.64 . . . . 0.0 109.733 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -84.96 166.24 16.93 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 170.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 167.83 -171.81 42.4 Favored Glycine 0 CA--C 1.53 0.987 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.46 -150.9 8.22 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 118.93 1.365 . . . . 0.0 112.854 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.2 p -85.11 171.15 12.25 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.437 1.495 . . . . 0.0 112.051 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.6 mtt180 -130.04 62.03 1.57 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.572 1.149 . . . . 0.0 110.87 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 2.7 mtt -82.04 149.39 28.11 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.171 -0.955 . . . . 0.0 108.443 175.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -90.44 140.74 29.44 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.619 0.768 . . . . 0.0 110.855 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -117.55 -21.95 8.34 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 172.218 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 68.25 19.23 9.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.753 1.221 . . . . 0.0 112.213 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 81.2 p -120.59 155.5 56.73 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 126.44 1.896 . . . . 0.0 110.784 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.2 -28.57 47.99 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.543 2.162 . . . . 0.0 111.815 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.8 -8.41 87.77 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-O 117.994 -1.448 . . . . 0.0 113.126 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.63 -47.74 9.75 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-N 119.74 1.77 . . . . 0.0 109.315 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -70.21 -24.05 63.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.072 0.936 . . . . 0.0 113.367 -167.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.9 tt -64.49 -9.1 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 O-C-N 121.679 -0.638 . . . . 0.0 112.276 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.454 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 8.3 tm-20 -61.47 -16.09 43.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.366 2.266 . . . . 0.0 111.848 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -83.71 -29.05 33.34 Favored Glycine 0 CA--C 1.525 0.672 0 O-C-N 120.079 -1.638 . . . . 0.0 112.947 170.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.65 -47.09 20.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.713 1.256 . . . . 0.0 109.621 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.802 ' CZ ' HD13 ' A' ' 109' ' ' LEU . 0.3 OUTLIER -61.09 -37.45 82.79 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 122.965 0.506 . . . . 0.0 111.524 -162.149 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.802 HD13 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -69.96 -47.28 62.93 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.571 1.948 . . . . 0.0 109.386 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -14.15 56.22 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.402 1.081 . . . . 0.0 113.062 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -94.97 -28.97 14.88 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.057 1.343 . . . . 0.0 111.502 174.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.6 mt -71.59 -8.93 57.11 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.683 -1.261 . . . . 0.0 113.194 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 9.9 p -80.56 -9.94 59.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.17 0.895 . . . . 0.0 112.338 171.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -122.35 71.05 1.0 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 125.208 1.403 . . . . 0.0 109.759 -168.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.4 mm -103.61 54.16 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -28.42 69.89 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.803 -0.56 . . . . 0.0 111.048 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -141.14 166.23 25.34 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.665 1.586 . . . . 0.0 110.266 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.2 t -160.05 161.93 34.06 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.22 83.61 0.14 Allowed Glycine 0 CA--C 1.524 0.651 0 CA-C-O 119.799 -0.445 . . . . 0.0 113.286 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.5 p -91.14 97.19 6.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.684 1.742 . . . . 0.0 111.83 170.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.72 98.63 9.78 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.493 1.117 . . . . 0.0 108.512 171.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.0 mtt -86.32 30.57 0.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.411 1.484 . . . . 0.0 114.415 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.02 89.85 3.21 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 120.292 -1.505 . . . . 0.0 110.7 -166.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -36.53 120.56 0.76 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 126.441 1.897 . . . . 0.0 112.652 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.06 126.68 9.24 Favored 'Cis proline' 0 N--CA 1.459 -0.554 0 CA-C-N 119.908 1.003 . . . . 0.0 111.724 1.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -83.84 145.04 28.87 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -140.32 179.61 6.55 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 165.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -132.93 147.65 52.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 162.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -119.04 151.12 38.81 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 126.266 1.826 . . . . 0.0 108.0 170.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.5 mt -114.44 153.44 29.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 113.541 -1.663 . . . . 0.0 106.724 155.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 41.9 t -140.49 118.98 10.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 173.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 39.5 mt -76.18 173.65 11.07 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.288 1.042 . . . . 0.0 110.933 178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -57.56 -17.62 15.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.267 1.427 . . . . 0.0 113.355 158.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -78.5 -2.44 38.66 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.38 16.96 78.75 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 124.074 0.845 . . . . 0.0 112.457 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -173.24 0.44 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.831 0.852 . . . . 0.0 112.237 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 31.4 m -148.79 125.66 11.23 Favored 'General case' 0 N--CA 1.461 0.125 0 O-C-N 119.165 -2.21 . . . . 0.0 108.189 159.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.673 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -105.48 161.2 14.55 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.094 0.958 . . . . 0.0 108.485 170.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 30' ' ' LEU . 42.1 m -143.08 123.33 13.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.297 0.639 . . . . 0.0 110.515 -168.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.439 ' CZ ' HD23 ' A' ' 30' ' ' LEU . 66.6 m-85 -125.88 143.6 51.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.327 1.851 . . . . 0.0 110.981 -172.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -80.45 164.9 22.68 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 119.612 1.096 . . . . 0.0 108.813 175.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.448 ' HE ' HG21 ' A' ' 144' ' ' THR . 6.5 tpt180 -87.62 97.72 11.02 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 156.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.7 t -109.62 52.87 0.71 Allowed 'General case' 0 C--O 1.219 -0.516 0 O-C-N 120.955 -1.09 . . . . 0.0 108.552 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . 0.448 HG21 ' HE ' ' A' ' 142' ' ' ARG . 1.4 t -76.88 8.02 4.18 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.372 -0.83 . . . . 0.0 111.987 176.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 124.062 0.945 . . . . 0.0 109.732 -173.824 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -131.16 144.78 54.92 Favored Pre-proline 0 N--CA 1.469 0.51 0 C-N-CA 123.841 0.856 . . . . 0.0 111.202 -166.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.15 -12.0 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.175 2.583 . . . . 0.0 112.257 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.95 -2.1 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.788 -1.195 . . . . 0.0 113.002 165.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.6 21.93 10.74 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.909 2.083 . . . . 0.0 110.818 172.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.4 m -84.8 -62.55 1.52 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.945 1.248 . . . . 0.0 113.949 169.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.546 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -61.43 -26.09 67.65 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.081 1.764 . . . . 0.0 115.237 -160.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.73 -6.11 48.96 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.838 1.655 . . . . 0.0 111.168 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.14 17.31 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.689 1.196 . . . . 0.0 111.963 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.03 -11.25 44.71 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.007 1.723 . . . . 0.0 112.054 171.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -128.11 -12.04 5.23 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.418 HG22 ' NH2' ' A' ' 142' ' ' ARG . 75.0 p -82.62 170.25 15.36 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.593 -0.692 . . . . 0.0 111.839 -172.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -144.64 148.95 34.91 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -153.14 165.63 35.05 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 125.209 1.404 . . . . 0.0 108.98 -164.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 74.3 t -143.04 120.66 6.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.75 132.77 53.34 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -139.21 -14.12 1.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.078 0.769 . . . . 0.0 113.078 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.43 43.82 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.916 1.234 . . . . 0.0 109.337 166.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -142.06 93.96 2.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 133.96 45.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 171.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -65.02 164.41 12.85 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 156.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.1 65.57 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.937 0.495 . . . . 0.0 111.992 -172.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.21 -18.43 23.47 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.327 1.051 . . . . 0.0 112.529 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 127.37 -6.05 7.16 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 115.082 0.793 . . . . 0.0 115.082 176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -69.27 103.62 2.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 119.362 1.581 . . . . 0.0 108.72 176.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 122.75 18.39 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 121.196 -0.94 . . . . 0.0 108.977 170.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.8 mtt180 -75.89 153.3 36.82 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.597 1.559 . . . . 0.0 110.312 174.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.56 125.5 26.72 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 123.775 0.83 . . . . 0.0 109.97 168.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.0 m -131.29 155.31 81.68 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 126.139 1.776 . . . . 0.0 108.028 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.49 120.88 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.568 2.178 . . . . 0.0 110.802 -178.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 168.03 8.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.346 -0.846 . . . . 0.0 111.913 164.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.28 -32.04 64.19 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 121.346 -0.846 . . . . 0.0 111.757 167.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.39 -13.3 52.61 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 121.63 -0.669 . . . . 0.0 112.517 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -75.49 -17.7 60.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.95 -22.72 5.68 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 123.735 0.683 . . . . 0.0 114.131 163.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.64 85.47 3.68 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.397 1.099 . . . . 0.0 111.087 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.84 154.26 71.38 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.93 1.753 . . . . 0.0 111.578 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.6 mt -87.48 103.22 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 127.382 2.273 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 p -123.88 135.68 53.87 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.336 -164.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -128.88 135.52 49.18 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.452 1.901 . . . . 0.0 109.432 -167.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.0 m -146.35 115.27 6.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -104.51 112.21 25.18 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.6 t -161.02 -174.5 4.41 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.3 p -93.75 35.42 1.14 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.969 0.908 . . . . 0.0 112.178 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.7 t -50.49 -55.27 16.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.856 1.207 . . . . 0.0 114.191 -161.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -94.0 8.8 40.06 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.572 1.078 . . . . 0.0 110.669 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.48 -24.51 5.25 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.199 1.381 . . . . 0.0 114.615 165.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.4 166.37 14.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 128.111 2.565 . . . . 0.0 109.288 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 3.9 ptp85 -66.94 97.01 0.46 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.71 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.5 170.86 15.0 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 123.839 1.78 . . . . 0.0 113.002 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.91 75.18 0.94 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 112.036 -2.347 . . . . 0.0 107.131 -175.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.91 86.61 4.79 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -128.68 179.49 16.58 Favored Glycine 0 CA--C 1.507 -0.415 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 -165.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -118.51 140.03 50.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.855 0.836 . . . . 0.0 109.061 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -144.99 135.1 23.93 Favored 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 128.49 2.716 . . . . 0.0 104.757 -171.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 44.14 -91.83 0.01 OUTLIER Glycine 0 CA--C 1.524 0.608 0 C-N-CA 127.514 2.483 . . . . 0.0 112.465 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.4 t -152.63 33.1 0.5 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.721 1.248 . . . . 0.0 111.572 162.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -125.03 -7.17 7.19 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 120.547 -1.346 . . . . 0.0 114.012 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 44.89 177.52 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 129.114 2.966 . . . . 0.0 113.106 -175.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -154.95 159.21 40.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.117 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.21 160.0 23.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.746 1.618 . . . . 0.0 108.61 173.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 170.82 -86.06 0.08 OUTLIER Glycine 0 CA--C 1.527 0.822 0 CA-C-O 119.479 -0.623 . . . . 0.0 112.274 163.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 p -164.56 162.21 21.56 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.585 1.954 . . . . 0.0 110.099 -178.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 37.7 p90 -143.99 171.71 13.87 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.099 0.96 . . . . 0.0 110.876 165.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -149.48 142.15 24.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 126.161 1.784 . . . . 0.0 108.617 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -102.09 93.36 5.2 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 122.179 0.99 . . . . 0.0 109.762 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -124.16 176.75 6.2 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.653 1.981 . . . . 0.0 108.695 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 52.81 14.11 0.4 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.41 2.284 . . . . 0.0 116.078 174.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 56.38 35.77 67.18 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 120.082 -1.636 . . . . 0.0 111.856 -163.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -142.66 177.31 8.39 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 127.015 2.126 . . . . 0.0 112.353 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -87.13 139.9 30.1 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.1 p -131.91 148.38 52.53 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.448 1.476 . . . . 0.0 109.948 161.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.435 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.4 m-85 -112.88 157.66 21.15 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.286 1.034 . . . . 0.0 109.79 178.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.95 -153.43 25.72 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.646 1.117 . . . . 0.0 112.047 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.37 86.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.442 1.897 . . . . 0.0 108.694 170.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.468 HD13 HD23 ' A' ' 112' ' ' LEU . 67.2 mt -79.52 173.44 12.58 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 120.995 -1.066 . . . . 0.0 111.605 -175.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 159.01 179.42 33.84 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 170.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.09 -109.77 0.43 Allowed Glycine 0 C--N 1.333 0.384 0 C-N-CA 125.166 1.365 . . . . 0.0 111.01 -171.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -155.61 159.49 39.67 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.796 1.638 . . . . 0.0 107.958 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -103.14 38.37 1.77 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.591 1.556 . . . . 0.0 110.371 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mtm -59.85 162.54 5.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.164 0.986 . . . . 0.0 109.549 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -107.17 144.14 34.35 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -125.49 -15.85 6.0 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 176.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.259 18.1 ptp 46.39 44.57 12.94 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.186 1.794 . . . . 0.0 112.419 -174.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 80.0 p -132.55 157.43 78.34 Favored Pre-proline 0 C--O 1.239 0.527 0 C-N-CA 125.417 1.487 . . . . 0.0 109.58 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.79 -27.69 21.25 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 121.533 1.488 . . . . 0.0 112.045 173.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.472 ' O ' HG22 ' A' ' 104' ' ' ILE . . . -63.9 -36.1 92.85 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 169.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.08 -35.28 91.23 Favored Glycine 0 C--N 1.335 0.519 0 CA-C-N 120.096 1.948 . . . . 0.0 113.304 -170.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -86.12 -13.56 46.81 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.036 0.918 . . . . 0.0 112.85 -175.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 101' ' ' GLY . 9.7 tt -68.31 -9.9 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 118.918 0.781 . . . . 0.0 111.22 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -44.74 -51.3 9.46 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.824 0.85 . . . . 0.0 110.899 166.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.7 -39.01 92.99 Favored Glycine 0 C--N 1.337 0.639 0 CA-C-O 119.089 -0.84 . . . . 0.0 111.381 -173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.41 -45.83 65.16 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.475 0.71 . . . . 0.0 110.256 175.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -63.64 -45.12 91.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.781 0.832 . . . . 0.0 110.91 -171.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.0 mt -62.72 -36.37 82.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.197 0.908 . . . . 0.0 109.827 173.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -17.78 64.76 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.079 1.352 . . . . 0.0 113.143 175.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.03 -33.06 12.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.776 1.23 . . . . 0.0 110.658 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.468 HD23 HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -63.85 -21.44 66.44 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.546 1.538 . . . . 0.0 112.084 176.095 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -81.64 -9.42 59.67 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.478 1.511 . . . . 0.0 112.842 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -133.46 65.66 1.58 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -175.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.0 mm -89.15 69.98 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 103.413 -2.81 . . . . 0.0 103.413 163.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -73.27 -44.94 58.4 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 118.785 -1.166 . . . . 0.0 109.044 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -122.07 168.19 12.25 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.222 1.809 . . . . 0.0 109.767 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.2 t -163.67 170.9 16.41 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.853 -1.154 . . . . 0.0 108.482 -167.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -177.65 104.25 0.19 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.232 -1.147 . . . . 0.0 110.232 175.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.3 p -113.13 142.87 24.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 O-C-N 121.144 -1.209 . . . . 0.0 109.598 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -120.75 78.91 1.43 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 125.888 1.675 . . . . 0.0 106.745 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 48.1 ttm -76.09 62.85 1.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.381 171.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -147.23 104.97 3.71 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -45.37 125.51 5.91 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.988 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.66 124.0 8.77 Favored 'Cis proline' 0 N--CA 1.459 -0.553 0 CA-C-N 119.95 1.018 . . . . 0.0 111.629 3.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -79.0 134.6 36.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -141.43 162.39 35.59 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 163.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -127.06 147.52 50.15 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 126.133 1.773 . . . . 0.0 106.247 172.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -146.18 128.06 15.41 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -171.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -114.3 151.36 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.47 -0.769 . . . . 0.0 109.122 -178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.42 117.6 47.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.3 mp -68.73 169.21 11.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.783 0.801 . . . . 0.0 110.865 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -53.57 -33.26 54.13 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.584 1.554 . . . . 0.0 112.058 172.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -84.19 -27.38 28.07 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.478 -0.764 . . . . 0.0 112.148 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.37 -5.17 10.17 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 117.856 -1.524 . . . . 0.0 115.179 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -52.33 127.46 22.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.56 1.68 . . . . 0.0 108.771 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.2 m -105.5 98.14 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.918 1.287 . . . . 0.0 109.17 -170.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.3 mp -83.21 142.62 31.03 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.496 -1.377 . . . . 0.0 108.608 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 54.4 m -123.73 132.04 53.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.492 1.117 . . . . 0.0 109.888 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -128.76 133.6 48.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.586 1.554 . . . . 0.0 109.384 -175.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.62 158.87 20.74 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.418 ' NH2' HG22 ' A' ' 26' ' ' THR . 10.9 tpt180 -84.16 133.97 34.59 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -117.23 65.92 0.73 Allowed 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 7.3 t -74.81 -1.04 20.35 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 124.464 1.105 . . . . 0.0 111.569 -167.913 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 CA--C 1.535 0.373 0 CA-C-O 122.015 0.912 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.505 HD22 ' HB3' ' A' ' 18' ' ' ALA . 15.7 t30 -166.11 148.25 6.14 Favored Pre-proline 0 C--O 1.238 0.454 0 O-C-N 121.161 -0.962 . . . . 0.0 108.581 166.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -63.26 -26.61 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.753 2.302 . . . . 0.0 111.276 173.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.505 ' HB3' HD22 ' A' ' 16' ' ' ASN . . . -69.13 4.11 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.529 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -99.52 -13.99 19.24 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 120.138 1.335 . . . . 0.0 111.126 165.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.46 -20.11 34.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.696 1.134 . . . . 0.0 112.883 -172.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -8.5 33.33 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 120.577 -1.327 . . . . 0.0 113.572 176.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.79 13.78 29.29 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.374 1.07 . . . . 0.0 109.867 -177.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.81 31.25 0.36 Allowed 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.007 -1.058 . . . . 0.0 110.543 177.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -85.04 -54.53 4.58 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.403 0.681 . . . . 0.0 110.044 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -118.39 2.65 11.88 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.8 1.64 . . . . 0.0 113.398 -173.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.8 p -78.97 156.33 28.53 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 123.229 1.49 . . . . 0.0 111.344 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.66 154.54 51.48 Favored 'General case' 0 N--CA 1.441 -0.925 0 O-C-N 120.332 -1.48 . . . . 0.0 109.063 -177.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.499 ' HD1' HD12 ' A' ' 54' ' ' LEU . 32.3 m95 -152.9 162.18 41.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -164.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.9 t -144.66 132.82 17.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 138' ' ' LEU . 12.0 tp -81.15 150.95 28.49 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -173.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.6 t -139.22 -23.4 0.9 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.62 161.15 43.13 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.227 -1.546 . . . . 0.0 110.224 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.615 ' CG ' HD21 ' A' ' 138' ' ' LEU . 1.3 t90 -140.31 139.28 35.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.772 1.629 . . . . 0.0 107.315 169.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.99 135.99 54.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.739 1.616 . . . . 0.0 109.683 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -69.19 160.89 30.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 109.191 163.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.01 73.64 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 111.977 172.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.89 -4.13 42.2 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.612 -0.68 . . . . 0.0 111.72 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.85 -3.05 62.37 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-O 118.26 -1.3 . . . . 0.0 112.178 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.6 m -60.67 103.95 0.3 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.053 1.427 . . . . 0.0 107.742 170.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.5 132.9 55.39 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 165.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.91 147.58 26.19 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 169.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.26 144.25 54.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 161.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -141.67 152.34 62.67 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 126.129 1.772 . . . . 0.0 106.776 170.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.08 117.29 4.62 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 121.192 1.261 . . . . 0.0 108.894 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -76.22 174.36 10.22 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.37 72.21 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.189 -0.944 . . . . 0.0 111.215 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -77.66 -7.23 56.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -79.24 -9.0 59.47 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.341 -0.849 . . . . 0.0 111.937 168.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.27 -23.7 17.8 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 118.741 -1.033 . . . . 0.0 113.179 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.02 76.7 21.73 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.632 1.173 . . . . 0.0 110.426 -168.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.87 128.21 21.43 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 122.331 2.021 . . . . 0.0 110.27 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.5 mm -60.28 96.52 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.202 1.801 . . . . 0.0 109.805 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.9 p -108.55 122.34 46.86 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.35 1.06 . . . . 0.0 108.858 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.499 HD12 ' HD1' ' A' ' 28' ' ' TRP . 1.9 tm? -109.28 140.5 42.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.72 1.608 . . . . 0.0 107.877 -177.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 m -139.61 122.78 16.91 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -92.7 136.49 33.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 156.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.7 t 174.55 -154.82 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.718 2.807 . . . . 0.0 106.044 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.3 p -123.84 42.49 3.22 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.94 1.296 . . . . 0.0 111.913 -172.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.86 -6.75 2.95 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 119.546 -1.971 . . . . 0.0 114.729 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 70.8 p -122.94 -1.41 8.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.583 1.553 . . . . 0.0 112.06 166.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.55 -7.18 74.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.372 1.463 . . . . 0.0 113.24 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -89.68 170.33 10.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.005 1.903 . . . . 0.0 109.143 170.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -69.75 86.23 0.49 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 160.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.5 141.33 47.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.849 1.66 . . . . 0.0 107.388 -171.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.7 151.37 23.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.23 132.03 22.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 162.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.76 164.92 33.87 Favored Glycine 0 C--N 1.33 0.195 0 O-C-N 121.141 -0.974 . . . . 0.0 110.924 -178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -95.5 120.52 35.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -83.12 -158.67 0.29 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.591 1.156 . . . . 0.0 108.378 166.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . 0.419 ' HA3' ' O ' ' A' ' 101' ' ' GLY . . . -72.36 -17.86 77.88 Favored Glycine 0 CA--C 1.526 0.748 0 O-C-N 121.082 -1.011 . . . . 0.0 114.597 -170.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 44.0 t -150.88 -41.32 0.12 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.221 0.609 . . . . 0.0 109.666 162.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -103.47 105.7 16.03 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-O 122.17 0.986 . . . . 0.0 108.855 -170.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -60.11 148.95 34.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.298 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -139.43 174.14 10.82 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 124.595 1.158 . . . . 0.0 109.104 -163.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -155.54 166.09 34.6 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.456 1.903 . . . . 0.0 108.736 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.62 166.05 20.72 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.52 1.057 . . . . 0.0 110.537 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 p -72.33 166.1 23.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 118.383 1.092 . . . . 0.0 111.306 -177.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -142.01 175.27 9.87 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.621 0.768 . . . . 0.0 110.955 171.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.78 12.31 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.518 1.927 . . . . 0.0 109.737 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.27 99.33 12.37 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.216 1.807 . . . . 0.0 106.399 168.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.26 165.14 32.79 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.563 1.145 . . . . 0.0 108.413 173.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 37.3 t70 60.34 6.24 1.0 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.595 1.958 . . . . 0.0 114.92 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.2 27.91 69.88 Favored Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.119 -1.613 . . . . 0.0 111.696 -163.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.418 ' HB2' ' CG2' ' A' ' 118' ' ' THR . 25.6 pttt -121.28 171.02 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.119 1.368 . . . . 0.0 109.089 166.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.3 tp -98.92 134.92 41.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 164.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.86 134.78 48.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 119.589 1.086 . . . . 0.0 108.538 166.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -90.41 -176.2 4.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.374 0.67 . . . . 0.0 110.362 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -120.92 -149.29 8.16 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 126.292 1.901 . . . . 0.0 109.508 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.9 t -69.66 85.98 0.47 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.5 mt -77.35 135.77 38.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.674 1.59 . . . . 0.0 109.363 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -169.32 168.88 41.59 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-O 121.638 0.577 . . . . 0.0 112.553 171.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.37 -168.83 13.25 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 125.1 1.333 . . . . 0.0 109.976 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.2 p -73.89 -179.05 3.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.54 1.136 . . . . 0.0 110.67 171.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -129.49 82.28 2.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.3 mtt -77.02 -175.87 3.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 167.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.84 110.69 16.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.081 0.953 . . . . 0.0 110.85 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 64.9 m -120.07 102.93 8.87 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 124.063 0.945 . . . . 0.0 108.552 164.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.45 57.16 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.643 2.777 . . . . 0.0 113.216 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -149.32 155.29 39.51 Favored Pre-proline 0 C--O 1.239 0.51 0 O-C-N 120.935 -1.103 . . . . 0.0 110.129 -161.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.62 -29.57 12.93 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.573 2.182 . . . . 0.0 111.126 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . 0.419 ' O ' ' HA3' ' A' ' 70' ' ' GLY . . . -76.11 -8.19 84.96 Favored Glycine 0 C--O 1.217 -0.945 0 CA-C-O 117.5 -1.722 . . . . 0.0 111.471 172.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.38 -59.12 2.07 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 120.769 2.284 . . . . 0.0 110.698 175.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.83 -12.26 60.25 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -165.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -65.15 -16.9 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 125.837 1.655 . . . . 0.0 113.335 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -45.38 -50.44 12.28 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.871 1.268 . . . . 0.0 111.319 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -56.52 -37.79 77.14 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-N 118.87 0.759 . . . . 0.0 112.179 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.25 63.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.256 1.028 . . . . 0.0 110.161 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -55.12 -48.09 74.1 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 15.0 mt -65.31 -38.73 91.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.938 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.08 -19.7 64.88 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -92.54 -43.95 8.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.734 1.214 . . . . 0.0 111.041 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.37 -18.14 60.78 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -175.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -72.63 -11.32 60.59 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.179 0.991 . . . . 0.0 113.066 174.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -124.45 56.39 1.28 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 120.333 1.424 . . . . 0.0 110.859 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.1 65.81 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.76 -31.61 59.61 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.193 -0.942 . . . . 0.0 109.997 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -124.19 162.81 22.86 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.004 1.321 . . . . 0.0 108.924 170.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' A' ' 84' ' ' LYS . 7.9 p -132.42 -163.7 1.37 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.081 0.952 . . . . 0.0 111.232 -162.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.8 83.5 0.04 OUTLIER Glycine 0 C--O 1.225 -0.463 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.998 156.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.2 p -97.86 151.0 4.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 119.109 1.454 . . . . 0.0 109.366 166.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.46 122.35 26.07 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 128.574 2.75 . . . . 0.0 104.474 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 4.0 ttm -114.01 42.55 2.02 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.752 2.021 . . . . 0.0 110.404 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -134.32 87.66 2.38 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.074 1.75 . . . . 0.0 107.973 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -47.72 133.79 10.93 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 125.897 1.679 . . . . 0.0 112.782 -162.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.66 122.61 7.92 Favored 'Cis proline' 0 C--N 1.346 0.441 0 CA-C-O 121.988 0.745 . . . . 0.0 113.083 4.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -82.06 126.77 32.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.346 1.058 . . . . 0.0 108.454 -174.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -141.73 149.16 40.14 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 55.5 ttp -126.98 141.57 51.76 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -170.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -112.82 150.06 32.19 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.776 ' H ' HD12 ' A' ' 130' ' ' LEU 0.272 0.1 OUTLIER -127.21 153.07 46.55 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 127.036 2.134 . . . . 0.0 105.646 155.199 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 t -141.81 122.89 12.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 103.378 -2.823 . . . . 0.0 103.378 -176.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.4 169.29 17.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.122 0.963 . . . . 0.0 110.181 -176.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.5 p-10 -52.07 -26.73 11.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.675 164.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -2.66 45.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.991 1.269 . . . . 0.0 112.734 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.28 16.06 45.2 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 0.974 . . . . 0.0 114.549 166.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.67 172.25 5.44 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.301 -1.117 . . . . 0.0 108.862 171.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.9 m -146.82 116.55 7.17 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 119.095 -2.253 . . . . 0.0 109.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.615 HD21 ' CG ' ' A' ' 33' ' ' TRP . 0.2 OUTLIER -105.16 161.16 14.5 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.646 1.178 . . . . 0.0 109.816 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 52.5 m -135.05 123.37 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.413 0.685 . . . . 0.0 110.195 -175.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -111.07 151.59 27.89 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 124.066 0.854 . . . . 0.0 111.531 165.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.59 150.4 20.75 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.843 1.257 . . . . 0.0 108.672 153.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -68.7 144.16 54.51 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 165.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.3 t -132.01 85.9 2.29 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 m -79.57 25.76 0.32 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.721 1.208 . . . . 0.0 110.67 167.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 . . . . . 0 C--O 1.247 0.952 0 C-N-CA 127.559 2.344 . . . . 0.0 110.571 -172.491 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 CA--C 1.54 0.579 0 N-CA-C 113.685 0.995 . . . . 0.0 113.685 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -90.6 148.12 37.91 Favored Pre-proline 0 CA--C 1.536 0.434 0 O-C-N 120.764 -1.21 . . . . 0.0 112.624 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -65.0 -36.14 39.65 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.167 2.578 . . . . 0.0 110.498 169.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.7 21.56 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.87 2.068 . . . . 0.0 113.155 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -117.41 -18.58 9.8 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 120.177 -1.577 . . . . 0.0 111.722 169.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.3 m -72.24 -13.51 61.54 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.712 0.687 . . . . 0.0 111.89 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -79.96 2.09 24.9 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.044 1.338 . . . . 0.0 114.289 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.38 2.65 24.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.016 0.927 . . . . 0.0 110.427 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.88 -3.44 25.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.215 1.406 . . . . 0.0 111.964 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.07 -13.7 29.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 128.222 2.609 . . . . 0.0 113.531 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.66 -17.62 3.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.379 1.871 . . . . 0.0 112.582 -169.301 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.2 p -71.23 172.31 9.52 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.343 1.057 . . . . 0.0 111.281 -169.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.49 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 70.2 m -143.24 -57.82 0.41 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.325 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.5 m95 63.75 173.59 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.689 1.596 . . . . 0.0 113.982 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.1 t -142.96 127.45 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 175.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 138' ' ' LEU . 36.2 tp -70.76 138.13 50.21 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -144.3 -20.71 0.55 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.88 155.63 49.54 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 120.595 1.543 . . . . 0.0 109.369 162.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -136.25 96.47 3.38 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 104.695 -2.335 . . . . 0.0 104.695 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -100.65 159.03 15.5 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 173.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -104.42 168.14 9.28 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 -174.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.15 -11.76 0.3 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.05 -3.33 12.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.63 1.104 . . . . 0.0 112.704 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.37 8.13 44.49 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 118.394 -1.226 . . . . 0.0 112.204 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.3 m -73.58 99.27 3.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.77 1.785 . . . . 0.0 109.025 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.67 110.92 2.18 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 163.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.9 mtt-85 -65.05 164.32 13.12 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.064 0.935 . . . . 0.0 108.936 169.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.63 144.04 28.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.049 165.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -146.17 163.05 32.43 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.038 2.135 . . . . 0.0 109.61 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.97 115.56 4.36 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 121.682 1.588 . . . . 0.0 109.825 170.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.69 172.77 10.83 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 122.957 0.503 . . . . 0.0 109.876 165.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.05 -44.67 79.06 Favored 'General case' 0 N--CA 1.462 0.168 0 O-C-N 121.61 -0.681 . . . . 0.0 109.943 172.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -65.38 -12.58 53.52 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -76.74 -5.07 46.57 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.579 -1.325 . . . . 0.0 113.095 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.72 -42.94 1.77 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 123.446 0.546 . . . . 0.0 112.407 167.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.89 82.74 63.32 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 125.286 1.435 . . . . 0.0 108.642 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.46 171.63 16.68 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 124.285 3.323 . . . . 0.0 111.452 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.9 mt -93.45 106.55 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 123.866 0.866 . . . . 0.0 109.594 176.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 p -81.59 162.46 23.12 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 166.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.21 163.71 26.11 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -154.89 129.26 9.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.507 -1.371 . . . . 0.0 109.54 178.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -135.1 66.2 1.53 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.272 1.429 . . . . 0.0 110.511 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -124.55 -172.86 2.65 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.134 0.974 . . . . 0.0 109.352 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.4 p -106.22 52.91 0.71 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.795 0.838 . . . . 0.0 110.31 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t -67.22 -21.5 65.75 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.984 -1.073 . . . . 0.0 112.76 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -96.4 1.59 51.86 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.404 1.456 . . . . 0.0 111.035 169.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.48 -1.04 10.11 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 126.146 1.831 . . . . 0.0 113.034 -167.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -99.47 172.34 7.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.889 1.844 . . . . 0.0 108.191 151.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -86.79 86.03 7.31 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 125.795 1.638 . . . . 0.0 107.078 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -120.02 106.54 12.11 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.331 1.452 . . . . 0.0 111.358 -162.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 143.69 44.63 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.922 2.089 . . . . 0.0 108.847 172.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.91 176.71 10.84 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 125.499 1.52 . . . . 0.0 108.384 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.68 163.49 20.52 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 73.6 t80 -89.46 109.84 20.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 162.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.5 t -85.62 172.62 10.76 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.396 0.998 . . . . 0.0 108.569 165.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.66 -40.15 6.37 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 126.499 2.0 . . . . 0.0 116.225 -155.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.4 t -116.62 -29.5 6.09 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.171 -0.605 . . . . 0.0 112.048 169.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -131.32 125.0 31.61 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.346 1.07 . . . . 0.0 108.468 -164.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -62.75 151.66 37.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.409 165.323 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -140.39 174.48 10.47 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.571 1.548 . . . . 0.0 109.131 -175.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.4 ptp -154.76 166.28 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 126.079 1.752 . . . . 0.0 109.684 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 167.0 -178.82 41.08 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.184 1.373 . . . . 0.0 111.151 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.6 p -108.86 120.09 41.48 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.951 -1.323 . . . . 0.0 110.963 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.2 p90 -88.94 -173.37 4.06 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -167.18 129.85 1.72 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.751 1.16 . . . . 0.0 109.723 166.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.0 139.28 34.63 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.621 0.646 . . . . 0.0 109.362 172.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 8.3 ptpt -168.94 157.72 8.22 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.409 1.884 . . . . 0.0 109.057 172.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 51.72 41.35 28.98 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.776 1.63 . . . . 0.0 113.735 170.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.11 1.98 11.86 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 120.145 -1.597 . . . . 0.0 114.09 -175.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -123.3 175.86 6.46 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 119.501 1.65 . . . . 0.0 110.731 -176.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 16.7 tp -114.82 124.79 52.64 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.9 p -107.44 153.52 22.69 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -121.31 153.51 37.62 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 125.486 1.515 . . . . 0.0 108.967 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -81.62 -175.43 50.27 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.064 0.84 . . . . 0.0 112.324 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -65.1 105.28 1.03 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 163.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 69.0 mt -88.94 166.71 13.75 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.594 0.757 . . . . 0.0 109.477 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.48 48.0 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.076 163.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -164.06 -121.06 0.55 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 76.6 p -128.15 -174.32 3.18 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.936 1.294 . . . . 0.0 109.944 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.3 mmm180 -130.46 45.46 2.81 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.224 1.81 . . . . 0.0 110.133 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.7 mtm -59.4 155.12 15.42 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.86 128.72 42.99 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 118.047 0.385 . . . . 0.0 111.053 -171.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 58.4 m -134.97 108.66 7.98 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 164.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 8.7 ptp -72.13 68.33 0.71 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 161.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 48.1 p -139.6 153.1 70.02 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.621 1.568 . . . . 0.0 108.394 173.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.88 -29.39 6.94 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.146 1.897 . . . . 0.0 110.561 174.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -72.9 -1.53 55.54 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-O 118.019 -1.434 . . . . 0.0 112.664 166.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -86.21 -58.53 1.96 Allowed Glycine 0 C--N 1.336 0.552 0 CA-C-N 119.552 1.676 . . . . 0.0 109.526 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.64 -10.19 43.49 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -167.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 tt -68.58 -15.5 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 O-C-N 121.32 -0.863 . . . . 0.0 111.935 174.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -44.83 -56.79 4.21 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.651 1.58 . . . . 0.0 110.959 173.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.6 -38.31 96.07 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-O 119.522 -0.599 . . . . 0.0 112.045 -177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.93 -41.77 82.03 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 117.696 0.748 . . . . 0.0 110.57 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -58.67 -51.7 68.81 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.231 1.013 . . . . 0.0 110.136 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.42 -42.61 78.3 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -11.02 60.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.76 -23.64 13.78 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 125.23 1.412 . . . . 0.0 111.049 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.88 64.49 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 120.025 1.284 . . . . 0.0 110.772 166.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 42.5 p -73.3 -1.31 17.47 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.17 -0.956 . . . . 0.0 111.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 -132.48 86.31 2.31 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.745 2.018 . . . . 0.0 106.854 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.9 mm -115.86 88.44 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 102.942 -2.984 . . . . 0.0 102.942 167.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -74.06 -42.11 60.7 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.469 -1.292 . . . . 0.0 108.796 169.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 -127.22 173.59 9.61 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.097 0.559 . . . . 0.0 110.98 -175.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 16.0 m -155.29 162.93 40.75 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 119.963 -1.71 . . . . 0.0 108.739 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.54 92.19 0.1 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 125.267 1.413 . . . . 0.0 109.737 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -90.87 135.64 26.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 118.195 0.998 . . . . 0.0 109.345 171.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -106.59 99.0 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 168.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 13.23 1.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.961 1.304 . . . . 0.0 112.697 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.81 132.12 54.44 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 126.782 2.033 . . . . 0.0 107.806 -175.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.91 124.45 58.3 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.273 1.429 . . . . 0.0 110.155 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.25 111.81 2.31 Favored 'Cis proline' 0 N--CA 1.457 -0.674 0 CA-C-N 120.364 1.166 . . . . 0.0 111.055 4.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -70.04 122.07 18.67 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -171.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -136.89 162.19 33.93 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.6 ttp -124.13 136.45 54.22 Favored 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 105.029 -2.211 . . . . 0.0 105.029 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -122.6 132.25 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 58.6 mt -136.55 153.65 50.93 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-O 122.884 1.326 . . . . 0.0 109.133 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.8 m -147.2 161.29 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.399 -3.001 0 CA-C-N 110.324 -3.126 . . . . 0.0 107.594 -160.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 8.4 mp -109.17 -174.58 2.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.494 -1.684 . . . . 0.0 107.56 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.73 -40.74 84.65 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 111.968 171.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -76.51 -20.63 56.73 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.495 0.589 . . . . 0.0 111.136 171.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.98 51.37 6.29 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 124.811 1.196 . . . . 0.0 112.826 -172.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -49.93 171.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 117.916 0.858 . . . . 0.0 109.704 149.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 52.4 m -150.21 92.37 1.87 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 119.601 -1.937 . . . . 0.0 109.685 -163.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.578 HD23 HD11 ' A' ' 30' ' ' LEU . 3.6 mp -100.02 113.38 25.93 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.893 0.877 . . . . 0.0 109.878 -173.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.5 m -77.1 128.15 33.92 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 173.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -124.38 132.23 53.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 164.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -84.21 137.72 33.34 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.211 1.404 . . . . 0.0 108.255 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 132.15 51.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.735 1.152 . . . . 0.0 108.016 173.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . 0.403 ' C ' ' H ' ' A' ' 145' ' ' ARG . 0.4 OUTLIER -141.38 68.98 1.33 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.917 1.341 . . . . 0.0 107.917 170.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 52.3 m -87.31 38.82 0.84 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.759 1.624 . . . . 0.0 106.844 159.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 143' ' ' SER . 47.2 mtt180 . . . . . 0 C--O 1.247 0.96 1 C-N-CA 132.508 4.323 . . . . 0.0 105.063 175.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 . . . . . 0 C--O 1.235 0.295 0 CA-C-O 122.391 1.091 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -134.79 143.91 48.37 Favored Pre-proline 0 N--CA 1.435 -1.207 0 C-N-CA 124.805 1.242 . . . . 0.0 108.615 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -70.29 -23.75 28.01 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 122.385 2.057 . . . . 0.0 110.67 166.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.45 14.07 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.841 2.057 . . . . 0.0 113.812 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.588 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -123.65 -12.22 7.68 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.121 2.168 . . . . 0.0 112.286 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.499 HG21 ' C ' ' A' ' 84' ' ' LYS . 3.4 m -82.7 -16.21 48.99 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 119.151 0.887 . . . . 0.0 112.384 -174.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -76.08 -0.72 22.85 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.82 -1.175 . . . . 0.0 114.141 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.2 3.11 51.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.291 0.636 . . . . 0.0 110.773 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.48 32.78 0.16 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.678 1.991 . . . . 0.0 112.511 -171.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -94.07 -35.35 12.61 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.612 -1.305 . . . . 0.0 111.467 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -141.16 19.86 2.26 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 123.077 1.417 . . . . 0.0 109.868 -165.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.1 p -84.64 -170.58 3.19 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.887 -1.133 . . . . 0.0 108.268 167.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -152.37 -61.46 0.16 Allowed 'General case' 0 CA--C 1.506 -0.712 0 O-C-N 119.326 -2.109 . . . . 0.0 111.642 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 m95 65.9 159.46 0.12 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.81 1.767 . . . . 0.0 115.23 176.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.3 t -135.22 125.05 43.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 128.287 2.635 . . . . 0.0 107.845 174.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.62 126.5 27.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 170.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -126.85 -19.51 4.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 118.887 0.767 . . . . 0.0 112.085 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.08 156.4 43.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.974 -1.079 . . . . 0.0 110.635 163.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -132.1 100.27 4.99 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.95 139.14 33.52 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -80.93 170.59 16.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.73 0.812 . . . . 0.0 109.953 166.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.69 -35.23 74.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.329 0.652 . . . . 0.0 112.341 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -75.9 -12.31 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.601 -0.687 . . . . 0.0 111.824 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.98 14.02 32.39 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-O 118.808 -0.995 . . . . 0.0 113.039 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -79.01 108.99 12.9 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.263 1.531 . . . . 0.0 109.095 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 114.58 5.31 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.406 -0.809 . . . . 0.0 109.102 164.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 -64.61 163.64 13.34 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 124.677 1.191 . . . . 0.0 110.808 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.99 134.14 52.3 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 155.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.6 m -132.01 159.7 70.97 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 166.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.64 114.24 3.43 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.744 1.63 . . . . 0.0 110.983 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -71.22 173.27 7.92 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.185 -0.947 . . . . 0.0 110.288 170.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.76 -35.58 66.37 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.471 -0.768 . . . . 0.0 111.758 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -73.15 -20.9 60.81 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.037 0.535 . . . . 0.0 112.347 -178.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -73.35 -14.56 61.31 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.619 -0.676 . . . . 0.0 112.006 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.74 -19.46 54.53 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 124.398 0.999 . . . . 0.0 114.397 167.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -131.53 71.09 81.48 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 123.967 0.907 . . . . 0.0 109.738 171.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -63.21 156.95 52.37 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 122.223 1.948 . . . . 0.0 110.057 172.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.7 mt -89.8 134.9 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -130.51 165.5 22.55 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -135.14 155.04 51.38 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 175.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.2 m -151.73 115.15 4.8 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.387 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.7 113.56 25.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 170.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -161.75 -174.42 4.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.6 p -134.29 27.82 3.77 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.533 1.133 . . . . 0.0 112.116 -171.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 63.8 m -44.93 -36.48 3.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.052 1.741 . . . . 0.0 114.286 172.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.9 t -72.96 -28.75 62.59 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.669 1.122 . . . . 0.0 111.143 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.01 -23.54 5.54 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 127.536 2.494 . . . . 0.0 111.962 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 -117.57 172.21 7.49 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.852 1.661 . . . . 0.0 109.57 177.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -61.57 93.46 0.04 OUTLIER 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.262 1.025 . . . . 0.0 110.552 167.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -131.06 120.63 23.7 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 126.546 1.938 . . . . 0.0 107.14 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.94 30.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.985 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.2 p -152.79 174.25 14.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 159.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 163.89 -165.3 36.92 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 174.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -121.12 127.66 51.81 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -93.78 -7.15 44.31 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.246 1.418 . . . . 0.0 112.784 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 143.67 -44.8 0.92 Allowed Glycine 0 C--N 1.336 0.556 0 CA-C-N 118.382 0.537 . . . . 0.0 112.005 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 5.4 p -157.98 -32.03 0.07 Allowed 'General case' 0 CA--C 1.52 -0.201 0 O-C-N 120.86 -1.376 . . . . 0.0 111.717 173.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.63 -0.02 46.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -173.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . 0.278 0.8 OUTLIER 48.01 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 127.471 2.308 . . . . 0.0 113.385 -175.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -154.53 164.97 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.498 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.28 173.73 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.493 2.717 . . . . 0.0 107.707 167.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 148.53 174.69 20.44 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 125.628 1.585 . . . . 0.0 110.146 170.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.5 p -71.93 169.18 16.4 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.714 0.769 . . . . 0.0 110.755 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -148.99 174.78 11.91 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.471 0.708 . . . . 0.0 109.334 167.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.94 148.62 23.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.871 1.268 . . . . 0.0 108.983 169.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 114.4 26.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -151.11 166.26 31.35 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 53.55 13.4 0.47 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.233 1.813 . . . . 0.0 115.463 174.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.43 17.34 78.92 Favored Glycine 0 CA--C 1.531 1.059 0 O-C-N 120.495 -1.378 . . . . 0.0 112.56 -170.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.499 ' C ' HG21 ' A' ' 20' ' ' THR . 10.9 pttt -131.33 179.24 6.14 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 127.195 2.198 . . . . 0.0 110.129 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.05 109.39 20.82 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 104.433 -2.432 . . . . 0.0 104.433 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 57.6 p -97.45 152.82 18.58 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.019 0.827 . . . . 0.0 109.629 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.0 -164.81 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 110.266 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.9 -156.68 8.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 125.931 1.729 . . . . 0.0 111.595 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 t -74.71 71.03 1.91 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 172.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.1 mt -66.36 155.06 38.42 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.54 1.136 . . . . 0.0 108.096 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.85 -175.88 43.62 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 169.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.15 -149.72 5.18 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-O 121.794 0.663 . . . . 0.0 111.558 -167.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.3 p -100.18 -172.14 2.16 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 124.227 1.011 . . . . 0.0 109.993 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 mmt180 -135.5 87.84 2.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 171.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.3 mtt -114.42 165.2 12.97 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.633 1.173 . . . . 0.0 110.075 173.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.57 150.43 47.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 122.774 1.273 . . . . 0.0 110.602 163.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -145.09 147.16 32.24 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 130.411 3.484 . . . . 0.0 106.637 163.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ptp -129.09 28.6 5.27 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.953 1.701 . . . . 0.0 109.835 -177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.7 p -132.02 154.22 81.63 Favored Pre-proline 0 N--CA 1.446 -0.666 0 C-N-CA 125.953 1.701 . . . . 0.0 107.663 -168.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.15 -41.93 11.89 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.303 1.335 . . . . 0.0 109.348 176.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -62.51 -17.14 56.51 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-O 118.003 -1.443 . . . . 0.0 113.268 176.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.86 -56.11 12.01 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 120.102 1.951 . . . . 0.0 110.869 167.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -73.94 -18.39 60.9 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.471 1.136 . . . . 0.0 113.047 -162.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 18.2 tt -66.77 -13.72 16.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 123.278 0.631 . . . . 0.0 111.403 172.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -50.06 -43.24 51.06 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 125.426 1.49 . . . . 0.0 111.439 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.71 -42.6 98.01 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-O 119.417 -0.657 . . . . 0.0 111.611 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.61 69.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.632 0.716 . . . . 0.0 109.638 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.72 -54.48 38.61 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.993 0.917 . . . . 0.0 110.477 -175.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.48 -50.05 66.18 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 174.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -48.31 74.23 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.89 0.314 . . . . 0.0 111.225 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.01 64.43 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.232 1.013 . . . . 0.0 112.88 -173.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.08 -14.72 61.45 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.782 1.174 . . . . 0.0 112.293 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 26.4 p -84.46 4.39 31.89 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 119.287 0.949 . . . . 0.0 111.368 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -133.38 80.88 1.9 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.43 2.292 . . . . 0.0 108.659 -171.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -118.03 51.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 119.331 0.969 . . . . 0.0 109.959 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.95 -32.58 73.02 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.973 -1.079 . . . . 0.0 111.622 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -128.32 168.09 16.02 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.182 1.393 . . . . 0.0 109.789 -175.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 t -162.97 -179.01 6.44 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.598 -164.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 172.3 69.79 0.04 OUTLIER Glycine 0 CA--C 1.534 1.221 0 CA-C-N 118.993 0.815 . . . . 0.0 114.279 -176.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.588 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.0 p -85.15 142.05 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-N 120.797 2.298 . . . . 0.0 109.078 171.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -105.76 96.2 6.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 166.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.565 ' HB2' ' HB1' ' A' ' 19' ' ' ALA . 32.2 tpp -81.96 60.62 4.88 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 171.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 110.14 2.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -48.23 132.34 12.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.893 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.57 119.82 5.5 Favored 'Cis proline' 0 C--N 1.347 0.493 0 CA-C-N 119.543 0.872 . . . . 0.0 111.3 -0.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.07 136.69 37.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -140.91 165.87 26.34 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.82 2.448 . . . . 0.0 105.605 171.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 27.7 ttp -131.29 128.88 40.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 174.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -112.62 146.39 38.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 169.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 37.5 mt -135.11 139.99 45.12 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 73.9 t -129.07 126.24 64.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 -168.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.9 mp -73.95 165.92 24.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 122.666 1.222 . . . . 0.0 108.733 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -58.01 -36.12 72.22 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.724 1.21 . . . . 0.0 109.892 167.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -72.04 -19.86 61.77 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.895 1.678 . . . . 0.0 110.498 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.44 12.54 57.06 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-O 118.307 -1.274 . . . . 0.0 114.388 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.33 145.59 47.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.09 1.945 . . . . 0.0 107.423 164.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 15.1 m -125.12 96.6 4.91 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 124.947 1.299 . . . . 0.0 109.163 -177.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.54 127.58 33.0 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.072 -1.018 . . . . 0.0 108.333 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 36.7 m -113.95 118.52 34.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.391 1.877 . . . . 0.0 107.644 -175.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -114.74 150.58 35.12 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.148 1.379 . . . . 0.0 108.785 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.13 149.3 21.57 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.279 1.031 . . . . 0.0 108.986 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.0 tpt85 -71.48 107.11 4.23 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 163.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.68 89.03 2.97 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 170.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 t -115.57 50.34 1.01 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 122.038 0.923 . . . . 0.0 108.91 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.019 -1.467 . . . . 0.0 107.778 -179.213 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 . . . . . 0 CA--C 1.54 0.564 0 CA-C-O 121.368 0.604 . . . . 0.0 111.585 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.07 144.71 58.2 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.215 1.406 . . . . 0.0 111.175 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.18 -26.15 5.36 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.634 2.89 . . . . 0.0 111.474 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.69 30.32 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.114 1.365 . . . . 0.0 112.538 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.405 ' HB1' ' SD ' ' A' ' 122' ' ' MET . . . -120.71 -11.06 9.08 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.303 2.641 . . . . 0.0 110.558 173.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -59.63 -39.17 83.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.122 0.969 . . . . 0.0 112.389 -169.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -28.16 69.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.675 -1.265 . . . . 0.0 113.072 177.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.3 mp -81.86 34.68 0.4 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.947 1.699 . . . . 0.0 110.108 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.35 -6.45 17.16 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.461 1.105 . . . . 0.0 110.898 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -60.77 -27.81 68.26 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.294 1.837 . . . . 0.0 114.901 -166.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -102.14 -14.09 17.2 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.621 1.568 . . . . 0.0 113.083 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.2 p -89.43 174.88 7.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.756 -149.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 3.9 p -124.12 -73.96 0.63 Allowed 'General case' 0 CA--C 1.503 -0.84 0 O-C-N 121.13 -0.981 . . . . 0.0 112.388 -171.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 6.6 m95 69.82 162.68 0.23 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.584 1.954 . . . . 0.0 111.421 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.6 t -144.3 135.3 21.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 177.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.23 131.85 40.67 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.9 t -116.96 -26.17 6.97 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.626 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -153.87 146.38 24.07 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 121.325 1.875 . . . . 0.0 112.458 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.698 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -137.98 101.63 4.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 127.808 2.443 . . . . 0.0 107.36 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -84.8 131.87 34.49 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 169.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.82 167.12 17.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 163.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.28 -29.72 66.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.114 0.884 . . . . 0.0 112.459 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.29 -16.83 28.52 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.757 0.708 . . . . 0.0 112.582 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.2 -1.81 11.56 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.703 1.144 . . . . 0.0 113.4 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 m -64.33 93.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.667 1.734 . . . . 0.0 109.096 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.4 107.22 0.63 Allowed 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.677 -1.264 . . . . 0.0 109.719 169.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.45 142.75 57.73 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.63 130.94 41.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.7 m -128.77 153.88 79.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 174.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -70.1 113.32 3.39 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.129 1.219 . . . . 0.0 110.26 -177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -62.14 169.15 2.88 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.338 0.655 . . . . 0.0 110.664 166.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.35 62.53 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.978 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -102.01 -9.26 20.77 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -68.81 -15.26 63.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.268 -0.872 . . . . 0.0 112.024 173.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.67 -79.57 0.28 Allowed Glycine 0 C--N 1.336 0.551 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.26 86.18 58.58 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 128.211 2.604 . . . . 0.0 108.13 -168.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.85 160.21 47.89 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.443 2.096 . . . . 0.0 111.594 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 108' ' ' TYR . 26.6 mt -75.17 103.56 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 176.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 p -103.29 157.81 16.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.599 0.759 . . . . 0.0 109.644 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -127.21 157.92 38.51 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.516 1.127 . . . . 0.0 109.223 169.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -141.7 128.15 20.06 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.547 1.539 . . . . 0.0 108.328 163.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.98 121.13 38.53 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 126.457 1.903 . . . . 0.0 106.159 161.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -151.57 -167.72 2.88 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 173.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 p -131.26 21.82 4.81 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.755 1.622 . . . . 0.0 111.277 -171.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.3 t -63.28 -29.76 71.03 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.226 1.41 . . . . 0.0 113.819 -165.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -78.99 -10.73 59.92 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.098 -1.001 . . . . 0.0 111.346 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.16 -6.35 58.07 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 125.803 1.668 . . . . 0.0 111.667 -169.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -132.3 166.93 20.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.533 1.533 . . . . 0.0 110.215 -176.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.2 ptp85 -66.04 74.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.815 2.046 . . . . 0.0 111.944 173.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.25 140.9 36.78 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.39 148.11 38.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.3 p -152.3 166.75 30.83 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.58 -169.4 40.4 Favored Glycine 0 C--N 1.331 0.29 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.26 132.96 51.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 169.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.2 m -114.52 22.88 13.24 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.475 1.91 . . . . 0.0 110.836 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.56 -73.5 0.46 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-O 117.287 -1.84 . . . . 0.0 112.08 178.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -144.51 -4.92 0.76 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 121.579 2.69 . . . . 0.0 113.878 179.591 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.433 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 16.3 m120 -115.97 -6.27 11.99 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.226 1.411 . . . . 0.0 114.268 -172.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 61.98 174.86 0.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 131.493 3.917 . . . . 0.0 111.74 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -147.68 161.2 41.65 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.369 0.604 . . . . 0.0 111.719 170.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.8 164.83 37.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.576 2.351 . . . . 0.0 108.266 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.07 173.98 27.18 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 174.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.0 p -89.33 160.64 16.77 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 122.123 -0.633 . . . . 0.0 109.755 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -140.26 -174.62 3.99 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.756 -0.59 . . . . 0.0 111.75 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -153.19 165.76 34.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.627 1.571 . . . . 0.0 108.542 166.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 79.5 mt -128.88 105.43 8.22 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -163.08 170.34 18.08 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 126.181 1.792 . . . . 0.0 108.65 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.62 21.7 7.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.061 1.344 . . . . 0.0 112.966 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.36 19.88 64.8 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 118.467 -1.185 . . . . 0.0 112.653 -171.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -139.78 178.74 7.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.397 1.599 . . . . 0.0 111.19 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 tt -115.41 113.37 23.66 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.14 134.09 36.95 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 170.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -88.69 -172.78 3.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.08 -149.01 7.91 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 126.664 2.078 . . . . 0.0 109.641 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.0 t -61.56 110.34 1.45 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 mt -88.21 169.62 11.72 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.333 1.453 . . . . 0.0 109.4 171.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.55 177.59 46.51 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 158.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.1 -173.68 25.84 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 70.1 p -71.4 179.45 2.94 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.889 0.876 . . . . 0.0 111.425 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.49 47.65 2.51 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.183 1.393 . . . . 0.0 108.297 172.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.7 mtm -63.1 157.08 23.15 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -112.1 129.82 56.1 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 96.9 m -136.71 125.74 24.4 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.883 2.073 . . . . 0.0 108.319 -169.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.5 mtp -90.73 53.06 2.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.994 0.902 . . . . 0.0 109.795 -174.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.7 p -134.55 153.29 78.99 Favored Pre-proline 0 C--O 1.239 0.507 0 C-N-CA 124.394 1.077 . . . . 0.0 108.25 -170.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -72.63 -37.77 3.78 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.257 1.305 . . . . 0.0 108.883 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.07 15.64 6.36 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 118.056 -1.413 . . . . 0.0 111.933 172.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -113.19 -11.0 14.3 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-N 120.504 2.152 . . . . 0.0 111.855 163.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -88.39 -21.06 24.5 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 169.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.4 tt -71.16 -14.1 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 120.093 1.315 . . . . 0.0 113.179 -169.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -57.34 -41.44 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 121.004 -1.06 . . . . 0.0 112.516 -172.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.12 -47.44 87.57 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 124.346 0.974 . . . . 0.0 111.249 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.39 -51.42 67.62 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.755 0.778 . . . . 0.0 109.678 177.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.413 ' CE1' HG21 ' A' ' 52' ' ' ILE . 52.1 t80 -64.5 -40.57 95.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.487 0.315 . . . . 0.0 111.359 -170.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.3 mp -61.5 -37.19 82.78 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 121.256 -0.903 . . . . 0.0 110.467 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -21.16 65.07 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.36 -39.74 20.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.0 -13.5 35.99 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.134 0.974 . . . . 0.0 113.141 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 46.9 p -97.84 8.89 43.96 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.01 1.324 . . . . 0.0 110.838 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -134.96 65.21 1.57 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 109.637 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -100.85 79.37 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 169.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.83 -36.52 78.3 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 118.699 -1.2 . . . . 0.0 110.211 170.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.588 ' HG2' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -130.69 161.27 32.02 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.444 1.098 . . . . 0.0 110.966 -174.701 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.6 m -149.25 169.74 20.06 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 158.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -159.71 162.16 32.79 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 108.09 -2.004 . . . . 0.0 108.09 153.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 45.0 t -124.74 145.04 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -110.08 93.3 4.43 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 170.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.405 ' SD ' ' HB1' ' A' ' 19' ' ' ALA . 18.2 mtp -80.2 35.2 0.32 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.442 1.097 . . . . 0.0 111.495 176.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -132.12 124.71 29.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 -178.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.62 148.83 65.17 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.973 0.909 . . . . 0.0 110.573 -173.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.9 122.39 5.6 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 N-CA-C 108.895 -1.233 . . . . 0.0 108.895 -14.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -71.52 135.24 46.99 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.11 0.481 . . . . 0.0 110.705 -168.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -139.26 168.81 18.99 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.799 1.24 . . . . 0.0 109.282 174.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -132.2 143.63 50.08 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.666 1.986 . . . . 0.0 106.843 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -138.01 139.39 39.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.883 0.849 . . . . 0.0 110.333 -174.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.79 ' H ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -134.09 161.12 35.75 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 127.675 2.39 . . . . 0.0 109.516 176.881 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.588 ' HB ' ' HG2' ' A' ' 117' ' ' ARG . 25.2 t -133.54 136.55 54.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 103.642 -2.725 . . . . 0.0 103.642 172.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 1.4 mp -82.71 162.1 21.89 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 172.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -66.11 -26.57 67.52 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.483 0.659 . . . . 0.0 111.731 -173.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.36 -5.92 58.36 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.615 1.566 . . . . 0.0 111.619 176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 103.22 4.41 47.38 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.997 -1.446 . . . . 0.0 115.441 169.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -62.07 158.46 16.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.589 1.695 . . . . 0.0 109.25 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.0 m -128.54 115.25 17.83 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.806 1.242 . . . . 0.0 109.981 -176.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.698 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.2 mm? -116.03 152.23 33.96 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.722 -0.611 . . . . 0.0 109.61 -177.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 98.1 m -145.49 119.79 9.58 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.567 -164.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.571 ' CE1' HD11 ' A' ' 130' ' ' LEU . 78.0 m-85 -113.82 140.25 48.47 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 123.518 0.727 . . . . 0.0 110.28 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.4 136.11 33.98 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.415 1.486 . . . . 0.0 107.708 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -60.91 136.93 58.23 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 117.803 -1.094 . . . . 0.0 108.21 174.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.0 t -138.42 35.91 2.27 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 119.661 1.118 . . . . 0.0 111.189 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.9 m -76.75 25.21 0.14 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.943 1.297 . . . . 0.0 109.822 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.7 ttt180 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 127.85 2.46 . . . . 0.0 111.736 171.552 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 121.695 0.759 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -112.0 144.14 30.13 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.749 -170.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.46 -26.42 14.22 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.049 3.166 . . . . 0.0 111.902 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.77 49.82 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.584 171.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -156.16 -43.57 0.08 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.919 2.487 . . . . 0.0 108.26 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 m -60.8 -16.9 45.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.994 2.517 . . . . 0.0 114.206 -164.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -74.44 -24.05 59.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.943 1.697 . . . . 0.0 113.466 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -72.42 -4.42 30.08 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.467 1.507 . . . . 0.0 111.155 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 38.98 0.57 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.875 1.27 . . . . 0.0 111.278 -160.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.77 -51.54 7.14 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.692 0.797 . . . . 0.0 110.756 175.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.07 -3.09 28.16 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.211 1.004 . . . . 0.0 112.232 -158.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.61 167.24 11.6 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 123.059 1.409 . . . . 0.0 111.584 -156.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.9 p -141.72 155.69 45.64 Favored 'General case' 0 CA--C 1.496 -1.122 0 O-C-N 120.07 -1.644 . . . . 0.0 106.822 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.723 ' CD1' HD13 ' A' ' 54' ' ' LEU . 9.1 m95 -145.62 169.07 19.16 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.433 -175.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.0 t -136.02 124.03 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 169.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 52' ' ' ILE . 2.0 tm? -79.98 129.82 34.79 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 -7.78 3.57 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.91 141.7 19.05 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-N 119.666 1.121 . . . . 0.0 111.389 173.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.605 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -127.47 118.81 24.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 128.562 2.745 . . . . 0.0 106.19 174.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -98.71 130.75 45.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -66.28 168.26 9.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 118.359 0.527 . . . . 0.0 109.793 163.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.13 71.61 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.479 1.111 . . . . 0.0 112.14 -174.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -23.57 63.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.811 0.339 . . . . 0.0 110.733 -177.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 110.33 3.14 29.4 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.663 2.078 . . . . 0.0 112.248 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.6 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.049 1.424 . . . . 0.0 108.807 177.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.14 115.92 4.15 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 168.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.44 168.87 15.21 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.082 0.553 . . . . 0.0 109.623 172.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.75 152.3 27.06 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 151.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.42 ' HB ' ' HD2' ' A' ' 44' ' ' PRO . 23.4 m -140.36 165.65 28.79 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 125.983 1.713 . . . . 0.0 108.492 170.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 43' ' ' VAL . 19.5 Cg_endo -66.46 105.77 0.94 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.005 2.47 . . . . 0.0 110.454 169.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.444 ' H ' ' HG3' ' A' ' 48' ' ' GLN . 0.7 OUTLIER -73.18 174.87 7.37 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.563 1.145 . . . . 0.0 111.352 167.798 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.76 -49.33 76.93 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.932 0.493 . . . . 0.0 112.241 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.24 3.96 52.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.444 ' HG3' ' H ' ' A' ' 45' ' ' SER . 27.3 mm-40 -70.22 -24.99 63.19 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.328 -0.857 . . . . 0.0 110.641 171.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.66 -44.38 0.72 Allowed Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.306 0.955 . . . . 0.0 112.533 173.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.29 85.44 5.41 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 127.198 2.199 . . . . 0.0 109.953 -165.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -69.53 138.6 38.94 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 123.176 2.584 . . . . 0.0 112.807 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 30' ' ' LEU . 3.4 mt -62.95 119.43 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.927 0.891 . . . . 0.0 109.61 163.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -124.37 119.28 28.79 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 172.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.723 HD13 ' CD1' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -72.35 144.23 48.34 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.911 1.284 . . . . 0.0 108.608 173.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.9 m -148.77 103.02 3.34 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 166.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.502 HD22 HD22 ' A' ' 54' ' ' LEU . 1.6 mm? -82.26 126.81 32.54 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 162.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.7 t -170.25 -159.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.89 51.2 1.13 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.932 0.893 . . . . 0.0 112.231 171.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.1 t -57.88 -39.5 77.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.395 1.078 . . . . 0.0 112.526 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.51 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 3.6 t -81.33 -10.93 59.46 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.571 0.748 . . . . 0.0 112.361 174.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.09 -12.25 40.77 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.177 1.37 . . . . 0.0 112.87 -173.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -120.87 162.32 20.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.591 1.695 . . . . 0.0 110.168 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.4 ptp85 -63.06 94.97 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.553 0.741 . . . . 0.0 110.861 176.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.51 ' CE1' ' HB ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -138.7 154.41 48.58 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.144 0.973 . . . . 0.0 109.284 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.96 92.86 9.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -169.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.2 p -98.09 66.49 1.83 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 122.257 1.027 . . . . 0.0 109.84 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.06 161.29 26.63 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 29.4 t80 -88.0 119.41 28.34 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 157.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -83.92 176.57 8.79 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 160.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.77 11.16 6.1 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.958 1.266 . . . . 0.0 115.374 -155.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -159.38 3.29 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 141.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -135.84 125.69 25.73 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 106.135 -1.802 . . . . 0.0 106.135 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.549 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -69.5 139.61 53.88 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.772 -0.58 . . . . 0.0 110.03 168.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -112.74 169.04 9.18 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 126.236 1.814 . . . . 0.0 108.86 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.7 ptp -157.5 146.47 19.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.054 1.742 . . . . 0.0 107.516 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.56 156.33 7.97 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.571 -0.612 . . . . 0.0 111.571 168.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -94.83 120.5 35.15 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 122.613 0.365 . . . . 0.0 111.969 -146.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.501 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 41.3 p90 -98.0 171.09 8.49 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.195 0.522 . . . . 0.0 112.175 -169.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.51 145.67 25.35 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 126.738 2.015 . . . . 0.0 107.993 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.73 117.43 29.32 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 170.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -159.23 3.12 0.09 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -173.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -137.82 9.65 2.84 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.088 0.955 . . . . 0.0 113.454 -161.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.97 11.4 50.93 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.252 -1.53 . . . . 0.0 112.01 -157.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -137.87 165.94 25.25 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 126.93 2.092 . . . . 0.0 109.49 169.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -75.08 146.52 41.4 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 128.362 2.665 . . . . 0.0 107.375 163.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m -127.47 138.14 52.87 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 153.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -85.48 164.12 18.03 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.14 -171.65 44.45 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.108 -1.997 . . . . 0.0 108.108 165.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 m -58.37 106.53 0.39 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 165.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.4 mt -82.81 156.37 23.69 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -154.2 167.01 32.27 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 165.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.09 179.46 21.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.613 0.707 . . . . 0.0 111.901 -174.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.0 p -67.18 172.13 5.01 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -120.52 77.34 1.26 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 169.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 30.5 mtt -76.86 158.78 30.55 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -98.11 111.89 24.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.219 1.408 . . . . 0.0 108.243 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 77.9 m -145.58 129.08 16.99 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.847 0.832 . . . . 0.0 110.998 -167.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.3 mtm -107.54 57.17 0.63 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.115 1.766 . . . . 0.0 107.521 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.8 p -142.58 150.79 55.49 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 123.34 0.656 . . . . 0.0 110.396 -164.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.99 -21.76 31.98 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.26 1.974 . . . . 0.0 111.236 176.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.86 -14.88 68.88 Favored Glycine 0 CA--C 1.524 0.645 0 C-N-CA 124.723 1.154 . . . . 0.0 112.935 173.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 -38.98 68.67 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 118.582 1.191 . . . . 0.0 111.411 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -92.5 -26.24 18.04 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.621 0.71 . . . . 0.0 112.445 -173.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.72 -14.15 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 119.388 0.995 . . . . 0.0 111.451 174.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -50.34 -43.87 54.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.121 0.969 . . . . 0.0 110.551 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.84 97.56 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.565 -0.614 . . . . 0.0 111.565 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.89 -37.11 75.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 117.622 0.711 . . . . 0.0 110.522 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -62.47 -48.77 78.14 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.567 0.747 . . . . 0.0 109.992 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.0 -33.04 74.57 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.89 0.768 . . . . 0.0 110.737 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.22 -32.96 74.71 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.964 0.802 . . . . 0.0 111.992 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.73 72.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 123.367 0.667 . . . . 0.0 109.545 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -13.8 50.24 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 117.435 -1.269 . . . . 0.0 113.574 175.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 p -79.9 -9.46 59.68 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 121.012 1.733 . . . . 0.0 111.686 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -121.14 26.78 8.78 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.458 1.103 . . . . 0.0 112.386 -163.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.2 mm -68.54 90.92 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -90.13 -25.56 20.64 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 121.569 -0.707 . . . . 0.0 111.108 169.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -133.87 166.65 22.19 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 126.167 1.787 . . . . 0.0 110.307 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 m -160.21 146.59 15.67 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.54 1.536 . . . . 0.0 107.932 174.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -125.37 138.06 10.71 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 160.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.41 144.24 23.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 164.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -124.79 76.99 1.56 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 -173.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.5 mtp -81.16 27.31 0.41 Allowed 'General case' 0 C--O 1.23 0.069 0 C-N-CA 126.314 1.846 . . . . 0.0 113.821 -174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -121.51 109.06 14.37 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -51.52 126.22 29.53 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 124.271 1.029 . . . . 0.0 110.629 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.39 120.59 6.58 Favored 'Cis proline' 0 CA--C 1.534 0.52 0 O-C-N 122.63 0.805 . . . . 0.0 112.725 6.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -82.95 137.57 34.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.835 -0.541 . . . . 0.0 110.409 -170.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -142.51 175.85 9.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 107.573 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . 0.414 ' HB2' ' CE3' ' A' ' 28' ' ' TRP . 7.1 tmm? -128.25 157.44 40.88 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 126.725 2.01 . . . . 0.0 105.937 172.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -155.15 112.03 3.27 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 169.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.834 HD11 ' HB2' ' A' ' 138' ' ' LEU 0.333 0.4 OUTLIER -80.97 163.94 22.93 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 172.627 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.9 t -135.93 130.99 49.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 104.74 -2.319 . . . . 0.0 104.74 166.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 14.5 mt -83.11 164.8 20.03 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -54.7 -37.08 65.38 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.21 1.004 . . . . 0.0 111.679 173.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -80.22 -14.57 58.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.342 1.057 . . . . 0.0 111.993 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.38 -7.61 34.68 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.603 1.097 . . . . 0.0 114.613 174.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -55.02 144.65 22.75 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.265 1.532 . . . . 0.0 108.666 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.3 m -135.54 110.94 9.09 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 125.294 1.438 . . . . 0.0 108.013 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.834 ' HB2' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -105.86 155.83 18.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 121.254 -0.903 . . . . 0.0 108.938 176.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 89.5 m -132.78 114.93 14.69 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.094 1.497 . . . . 0.0 108.946 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.409 ' CD1' ' HE3' ' A' ' 128' ' ' MET . 8.7 m-85 -124.81 139.54 53.75 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -175.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.3 OUTLIER -93.79 142.65 27.13 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 123.787 0.835 . . . . 0.0 109.078 178.706 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -65.68 119.5 11.28 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 116.382 -1.771 . . . . 0.0 109.694 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 5.7 t -124.08 38.34 4.21 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.671 2.032 . . . . 0.0 113.217 -172.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.3 p -74.89 17.2 0.23 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.753 1.221 . . . . 0.0 112.214 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.973 0 C-N-CA 125.118 1.367 . . . . 0.0 113.292 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 . . . . . 0 C--O 1.233 0.221 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.496 HD22 ' HB3' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -147.39 149.79 35.55 Favored Pre-proline 0 CA--C 1.532 0.269 0 O-C-N 121.591 -0.693 . . . . 0.0 111.052 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.37 -32.34 8.2 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 123.891 3.06 . . . . 0.0 111.103 170.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.496 ' HB3' HD22 ' A' ' 16' ' ' ASN . . . -69.3 40.78 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.007 2.123 . . . . 0.0 112.243 175.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.626 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -143.03 -17.26 0.67 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.845 1.658 . . . . 0.0 112.069 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -31.64 72.22 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.49 1.496 . . . . 0.0 111.272 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -57.73 -20.47 34.8 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -173.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.33 6.23 38.16 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.638 1.175 . . . . 0.0 111.158 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -89.97 78.09 6.8 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.404 1.482 . . . . 0.0 108.373 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -134.45 -27.78 1.33 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -128.24 0.93 5.77 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.954 1.702 . . . . 0.0 111.118 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.9 p -74.27 -172.76 1.5 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 125.692 1.597 . . . . 0.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.697 ' OG ' HG23 ' A' ' 55' ' ' THR . 0.4 OUTLIER -151.24 -63.9 0.19 Allowed 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.453 -1.404 . . . . 0.0 110.536 -176.41 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.2 m95 65.12 159.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 123.227 1.489 . . . . 0.0 112.438 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.5 t -140.97 129.61 24.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 103.744 -2.687 . . . . 0.0 103.744 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.431 HD13 ' CE2' ' A' ' 140' ' ' PHE . 39.6 tp -66.91 154.8 40.11 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 172.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.09 -20.8 0.25 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.46 -1.4 . . . . 0.0 111.67 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.26 140.05 29.0 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 118.753 0.706 . . . . 0.0 109.824 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -118.03 98.61 6.41 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.536 1.134 . . . . 0.0 108.442 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.55 134.33 34.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -74.96 166.96 22.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 123.011 0.524 . . . . 0.0 109.599 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.38 16.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 129.395 3.078 . . . . 0.0 115.226 172.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.6 -18.38 3.53 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.377 2.271 . . . . 0.0 111.202 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.14 3.99 35.74 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.255 0.931 . . . . 0.0 113.914 -175.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.7 m -88.08 113.27 23.55 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.615 1.566 . . . . 0.0 111.747 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.48 108.82 2.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.767 1.227 . . . . 0.0 113.343 165.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.11 161.51 8.53 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 126.096 1.758 . . . . 0.0 112.09 176.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 128.65 38.15 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 117.995 -1.002 . . . . 0.0 108.59 161.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.46 163.57 33.45 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 126.027 1.731 . . . . 0.0 108.318 174.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.2 107.59 2.23 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.652 2.235 . . . . 0.0 110.756 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.99 169.48 6.73 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.213 1.005 . . . . 0.0 111.536 170.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.96 -54.8 32.79 Favored 'General case' 0 C--O 1.231 0.124 0 O-C-N 121.632 -0.668 . . . . 0.0 110.451 175.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -10.53 52.56 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -176.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -75.99 -17.33 59.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.102 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.7 -88.34 0.2 Allowed Glycine 0 C--N 1.337 0.636 0 CA-C-N 119.306 0.957 . . . . 0.0 110.73 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.96 86.12 19.1 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.324 2.25 . . . . 0.0 109.129 -170.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -71.66 175.31 9.74 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.811 2.341 . . . . 0.0 112.079 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.85 110.38 22.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 127.915 2.486 . . . . 0.0 109.276 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 p -114.91 117.59 31.08 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.74 1.616 . . . . 0.0 109.072 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -81.99 165.33 20.78 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.697 HG23 ' OG ' ' A' ' 27' ' ' SER . 3.6 m -145.55 134.78 22.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 163.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -119.99 97.87 5.81 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 174.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.3 t -150.66 159.36 44.56 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -176.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -108.46 59.56 0.61 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.896 0.771 . . . . 0.0 109.924 -173.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -32.79 69.53 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.129 -0.357 . . . . 0.0 111.092 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.4 p -90.53 10.18 26.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 111.516 177.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.87 -14.24 0.41 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 125.649 1.595 . . . . 0.0 113.596 -164.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.39 157.69 15.78 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 177.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.6 ptp85 -68.29 72.67 0.2 Allowed 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 126.17 1.788 . . . . 0.0 111.75 175.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 132.64 34.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.928 1.291 . . . . 0.0 110.854 176.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.7 118.04 36.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.14 154.89 50.15 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 168.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.33 169.68 42.56 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -175.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -96.96 125.49 41.42 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.509 ' HB2' ' CE2' ' A' ' 108' ' ' TYR . 28.3 t -109.27 91.1 3.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.949 0.795 . . . . 0.0 109.218 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 84.18 -64.84 4.2 Favored Glycine 0 C--N 1.332 0.355 0 CA-C-O 118.613 -1.104 . . . . 0.0 110.994 151.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -134.41 -1.07 2.89 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.647 1.224 . . . . 0.0 111.854 163.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -144.73 118.86 9.45 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.532 1.133 . . . . 0.0 108.493 -163.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.44 160.86 27.5 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.762 -1.211 . . . . 0.0 113.325 173.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -133.35 170.38 15.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.567 2.747 . . . . 0.0 112.061 -176.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -153.59 166.78 31.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.612 1.565 . . . . 0.0 111.597 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.69 -163.84 30.52 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.661 1.601 . . . . 0.0 110.25 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.4 m -127.71 155.26 44.26 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.373 1.469 . . . . 0.0 109.824 -164.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 52.3 p90 -138.97 179.47 6.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -174.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.82 148.2 30.65 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.297 1.839 . . . . 0.0 109.578 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 mp -117.31 103.78 10.49 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.248 2.219 . . . . 0.0 107.089 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.39 -175.08 5.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.549 168.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 53.42 16.19 0.84 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 165.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.81 14.26 58.03 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.051 -1.656 . . . . 0.0 114.285 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.4 pttt -132.72 160.73 35.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.716 1.758 . . . . 0.0 111.26 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.515 ' O ' HG21 ' A' ' 115' ' ' ILE . 17.1 tp -107.51 102.83 12.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 p -97.75 132.55 43.27 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.501 0.721 . . . . 0.0 109.077 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -96.19 -176.76 3.76 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.868 1.267 . . . . 0.0 109.944 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.67 -153.79 8.91 Favored Glycine 0 CA--C 1.521 0.45 0 C-N-CA 125.624 1.583 . . . . 0.0 111.062 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -64.27 85.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 123.228 1.489 . . . . 0.0 107.747 166.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 mt -78.34 178.31 7.77 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 119.923 -1.736 . . . . 0.0 108.52 169.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.97 -171.88 27.58 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 125.889 1.709 . . . . 0.0 109.41 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -179.43 -124.91 0.91 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 119.973 -1.108 . . . . 0.0 114.48 -171.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.1 p -102.59 169.67 8.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.346 1.058 . . . . 0.0 110.277 -165.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . 0.307 0.0 OUTLIER -128.05 40.91 3.59 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.294 1.038 . . . . 0.0 110.389 -174.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.0 mtt -58.8 140.9 54.44 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -91.14 124.89 35.7 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 91.3 m -136.99 169.09 18.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.121 1.368 . . . . 0.0 109.266 176.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.2 mtp -127.1 23.92 6.44 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.462 0.705 . . . . 0.0 110.26 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 43.8 p -101.89 158.75 31.17 Favored Pre-proline 0 C--O 1.238 0.481 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -168.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.22 -12.09 23.17 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.027 1.152 . . . . 0.0 112.159 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -92.61 -0.34 69.65 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 117.776 -1.569 . . . . 0.0 113.558 171.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.72 -45.67 4.19 Favored Glycine 0 CA--C 1.524 0.649 0 CA-C-N 120.239 2.019 . . . . 0.0 112.13 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -73.34 -22.5 60.29 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.812 1.306 . . . . 0.0 111.746 -174.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.7 tt -63.13 -14.33 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 O-C-N 121.503 -0.748 . . . . 0.0 112.352 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.514 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 5.3 tm-20 -66.56 -4.02 7.62 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.759 173.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.95 -64.17 1.9 Allowed Glycine 0 CA--C 1.533 1.214 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 164.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -33.29 74.47 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.287 -1.125 . . . . 0.0 112.626 -169.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.685 ' CE1' HD13 ' A' ' 109' ' ' LEU . 0.4 OUTLIER -63.6 -36.59 84.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.503 0.721 . . . . 0.0 110.428 -171.398 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.685 HD13 ' CE1' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -75.43 -23.21 56.93 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.694 1.198 . . . . 0.0 111.117 176.65 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.18 -24.17 40.51 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 171.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.95 -39.74 61.17 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 123.218 0.607 . . . . 0.0 109.493 173.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.3 -14.51 27.32 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 56.8 p -82.35 -4.31 57.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.671 1.578 . . . . 0.0 112.494 175.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -118.2 84.07 2.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.229 1.412 . . . . 0.0 109.252 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.515 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.5 mm -128.37 60.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.29 -29.48 66.24 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.556 1.169 . . . . 0.0 110.048 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.542 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -141.03 158.29 44.14 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.03 1.395 . . . . 0.0 112.781 -178.507 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 130' ' ' LEU . 21.0 m -151.41 171.98 16.66 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 125.336 1.454 . . . . 0.0 108.495 174.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.64 99.33 0.18 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 108.528 -1.829 . . . . 0.0 108.528 172.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.7 p -100.61 136.24 33.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 O-C-N 121.263 -1.139 . . . . 0.0 108.987 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -107.8 76.65 1.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.574 ' CG ' ' HB1' ' A' ' 19' ' ' ALA . 79.0 mmm -71.74 50.92 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.707 -1.245 . . . . 0.0 111.824 175.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.5 tpp85 -134.99 129.12 33.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.19 130.03 94.26 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 117.647 -1.168 . . . . 0.0 109.849 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.89 119.45 6.16 Favored 'Cis proline' 0 CA--C 1.54 0.81 0 CA-C-N 119.7 0.928 . . . . 0.0 112.824 3.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -84.76 131.78 34.52 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.92 1.288 . . . . 0.0 109.691 -168.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -141.85 167.96 20.89 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 125.803 1.641 . . . . 0.0 108.95 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 7.5 tmm? -122.75 134.99 54.43 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -119.1 144.44 46.6 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 162.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.87 ' H ' HD12 ' A' ' 130' ' ' LEU 0.305 0.1 OUTLIER -112.64 167.71 10.25 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.03 0.932 . . . . 0.0 109.072 160.491 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.542 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 59.4 t -124.0 147.87 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 157.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.11 161.03 15.27 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 172.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.21 -25.05 30.54 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.334 0.97 . . . . 0.0 111.526 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -82.43 -19.35 39.18 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 125.263 1.425 . . . . 0.0 112.009 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 113.94 -9.51 23.21 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.591 1.567 . . . . 0.0 114.484 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 148.19 23.97 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.64 1.72 . . . . 0.0 109.421 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.06 99.02 3.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.978 0.911 . . . . 0.0 108.682 -168.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 130' ' ' LEU . 6.4 mp -86.75 142.7 27.95 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 119.733 -1.855 . . . . 0.0 108.504 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 90.1 m -109.22 125.22 52.01 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.755 1.622 . . . . 0.0 107.822 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.431 ' CE2' HD13 ' A' ' 30' ' ' LEU . 57.4 m-85 -119.17 151.34 38.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 124.048 0.939 . . . . 0.0 110.453 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -99.32 147.83 24.79 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.937 1.695 . . . . 0.0 108.824 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -76.06 111.49 11.51 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 6.5 t -111.43 93.95 4.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 168.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 9.4 t -117.4 26.37 9.79 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.012 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.297 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 . . . . . 0 C--O 1.234 0.279 0 CA-C-O 122.389 1.09 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -70.99 143.68 89.22 Favored Pre-proline 0 N--CA 1.454 -0.256 0 CA-C-O 117.681 -1.152 . . . . 0.0 108.883 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -78.69 -16.75 12.89 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.959 2.439 . . . . 0.0 112.073 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.91 39.93 0.14 Allowed 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 122.751 1.262 . . . . 0.0 111.602 174.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 122' ' ' MET . . . -139.43 -46.22 0.46 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 130.065 3.346 . . . . 0.0 106.4 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.481 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -60.83 -20.69 62.16 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.593 1.157 . . . . 0.0 112.843 -176.123 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.3 -12.0 54.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 114.773 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 7.18 46.61 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.565 1.546 . . . . 0.0 110.589 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 20' ' ' THR . 2.7 mm? -82.15 56.32 3.14 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.381 -1.449 . . . . 0.0 109.312 -176.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -135.57 -40.22 0.71 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.623 -0.703 . . . . 0.0 112.296 -161.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.1 39.43 3.67 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 172.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 p -120.92 157.74 29.2 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.506 -1.371 . . . . 0.0 110.975 -174.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -127.6 152.47 47.6 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 123.99 0.916 . . . . 0.0 109.106 -178.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -149.59 162.5 40.07 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 113.257 -1.792 . . . . 0.0 108.604 -166.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.7 t -147.58 136.04 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 140' ' ' PHE . 17.2 tp -82.25 150.65 27.19 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 119.276 0.944 . . . . 0.0 110.311 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 t -134.31 -27.32 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 175.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -151.79 157.97 42.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.309 1.413 . . . . 0.0 110.389 177.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.745 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.2 t90 -143.35 106.6 4.55 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.082 2.153 . . . . 0.0 108.469 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.07 131.61 34.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 172.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -61.53 161.61 9.38 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 159.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -44.32 -42.95 7.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.158 1.783 . . . . 0.0 112.654 165.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.23 -14.23 62.17 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.683 1.593 . . . . 0.0 111.987 -173.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.55 1.72 58.93 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.948 1.737 . . . . 0.0 112.64 -175.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.1 m -69.4 108.89 3.92 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.073 1.749 . . . . 0.0 109.794 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.39 140.36 48.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.153 -0.967 . . . . 0.0 110.64 170.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -97.05 166.47 11.58 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.436 1.494 . . . . 0.0 111.606 -175.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.5 102.99 13.96 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 173.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 28.0 m -114.43 148.89 41.21 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 173.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.7 102.69 1.64 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.137 2.558 . . . . 0.0 110.203 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.08 169.31 0.4 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 126.162 1.785 . . . . 0.0 114.442 168.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.87 -37.38 71.26 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.046 0.938 . . . . 0.0 112.873 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -80.86 -15.2 57.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -73.85 -22.92 59.59 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 121.589 -0.694 . . . . 0.0 111.515 -172.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.56 -32.14 2.34 Favored Glycine 0 C--N 1.337 0.604 0 N-CA-C 115.335 0.894 . . . . 0.0 115.335 156.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.17 85.26 8.2 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 172.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 162.28 39.82 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.035 1.823 . . . . 0.0 111.22 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.7 mt -77.99 106.85 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 124.537 1.135 . . . . 0.0 109.093 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -99.41 159.02 15.32 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.377 0.671 . . . . 0.0 109.629 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -140.16 141.97 36.0 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.402 2.281 . . . . 0.0 106.465 165.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.2 m -134.37 145.84 49.35 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 120.833 -1.167 . . . . 0.0 108.146 159.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.4 mt -118.4 117.32 28.74 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 103.71 -2.7 . . . . 0.0 103.71 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -163.54 178.7 7.79 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 171.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.0 p -116.92 16.46 15.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -161.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -51.72 -32.68 31.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.1 p -65.97 -21.82 66.44 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 121.336 1.88 . . . . 0.0 111.875 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.92 -0.03 60.47 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.897 1.713 . . . . 0.0 111.01 -160.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -131.27 167.8 18.6 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.106 1.453 . . . . 0.0 109.771 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -71.51 80.38 0.79 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.732 2.013 . . . . 0.0 106.742 173.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -106.07 112.79 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.518 1.527 . . . . 0.0 109.083 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.54 149.88 45.32 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 168.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -145.65 152.42 39.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 167.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 176.71 -168.74 40.9 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 6.0 t80 -131.55 128.73 39.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 103.34 -2.837 . . . . 0.0 103.34 172.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.4 m -119.59 11.19 11.97 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.443 1.02 . . . . 0.0 113.594 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 169.25 -63.09 0.18 Allowed Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.295 -1.281 . . . . 0.0 112.122 168.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 9.2 t -166.96 9.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.632 1.716 . . . . 0.0 113.713 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -112.06 -7.66 14.08 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 118.813 -2.429 . . . . 0.0 112.92 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.402 ' HA ' ' HA ' ' A' ' 68' ' ' PHE 0.321 0.0 OUTLIER 44.21 179.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 127.615 2.366 . . . . 0.0 113.07 -164.246 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 10.2 p90 -160.25 166.77 28.94 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.645 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -157.37 168.3 27.77 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.957 2.503 . . . . 0.0 106.392 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 143.9 175.88 17.42 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.431 1.015 . . . . 0.0 110.876 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.4 m -79.54 164.43 23.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -166.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -142.55 176.84 8.72 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.642 1.177 . . . . 0.0 111.541 170.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -158.3 159.23 35.71 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.147 1.379 . . . . 0.0 110.283 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.87 128.62 50.6 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 125.385 1.474 . . . . 0.0 108.817 -177.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt 176.18 171.58 0.4 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 128.111 2.564 . . . . 0.0 107.175 -171.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t0 58.3 24.13 11.21 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 158.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.01 5.78 59.0 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 118.251 -1.305 . . . . 0.0 113.998 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.435 ' HA ' HG21 ' A' ' 20' ' ' THR . 14.5 pttt -131.31 168.41 17.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.806 1.803 . . . . 0.0 112.122 -171.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.5 tp -101.89 109.65 21.44 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 163.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -90.7 159.48 16.34 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -120.1 178.88 4.46 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.497 1.119 . . . . 0.0 110.126 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -101.87 -112.11 3.55 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 175.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 t -143.86 67.16 1.28 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 128.242 2.617 . . . . 0.0 105.284 -162.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.716 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -68.26 163.74 22.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.159 0.984 . . . . 0.0 111.031 -171.618 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.89 172.83 45.81 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 166.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.34 -134.46 2.8 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.2 p -103.22 -167.96 1.45 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.75 1.62 . . . . 0.0 109.774 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -128.24 67.47 1.36 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.045 1.738 . . . . 0.0 109.481 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.7 mtm -101.14 157.26 16.9 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.603 -0.685 . . . . 0.0 109.165 -176.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.27 118.72 32.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.038 0.935 . . . . 0.0 108.643 -171.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -102.37 -22.87 14.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 177.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.256 23.2 ptp 49.49 31.36 3.98 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -169.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 61.1 p -122.64 160.71 47.47 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.502 1.521 . . . . 0.0 107.47 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.8 -41.67 7.7 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.727 1.618 . . . . 0.0 111.632 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.93 -30.96 76.8 Favored Glycine 0 C--N 1.34 0.762 0 CA-C-O 118.699 -1.056 . . . . 0.0 111.005 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -68.98 -17.04 71.26 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.899 1.85 . . . . 0.0 113.242 173.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -98.91 -12.12 21.02 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.577 1.189 . . . . 0.0 112.385 -173.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.7 tt -81.95 -16.13 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -174.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -58.22 -37.65 75.26 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.911 0.778 . . . . 0.0 110.545 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.53 73.71 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-O 118.628 -1.095 . . . . 0.0 113.464 176.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.7 59.75 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 120.097 1.949 . . . . 0.0 110.158 173.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -71.52 -44.22 65.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.5 1.12 . . . . 0.0 110.668 -174.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.81 -28.17 68.59 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.566 -1.334 . . . . 0.0 111.272 172.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.56 -20.57 50.3 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 174.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.2 -37.61 25.8 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.457 1.503 . . . . 0.0 109.927 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -13.77 0.55 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.676 2.391 . . . . 0.0 114.584 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.3 p -114.96 -0.32 13.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.697 1.599 . . . . 0.0 113.09 -176.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -110.51 35.38 3.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.629 1.104 . . . . 0.0 109.973 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.3 mm -71.65 74.4 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.839 1.256 . . . . 0.0 108.017 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.87 -25.77 27.79 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.392 -0.817 . . . . 0.0 109.987 173.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -137.37 164.97 27.33 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 122.445 1.117 . . . . 0.0 112.609 174.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.4 m -158.6 162.91 37.36 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 127.577 2.351 . . . . 0.0 107.126 -176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.02 91.81 0.1 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 108.791 -1.724 . . . . 0.0 108.791 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 128' ' ' MET . 2.2 p -77.53 145.75 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 120.229 -1.748 . . . . 0.0 109.242 166.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -120.31 98.54 6.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.453 1.901 . . . . 0.0 107.401 174.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.424 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 12.2 mtp -88.42 1.79 54.01 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 177.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -61.81 132.08 51.96 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 157.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 140.73 98.16 Favored Pre-proline 0 N--CA 1.442 -0.852 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 170.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.42 118.68 4.71 Favored 'Cis proline' 0 N--CA 1.454 -0.8 0 CA-C-N 119.861 0.986 . . . . 0.0 110.558 -1.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -68.46 127.32 32.57 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.742 0.782 . . . . 0.0 109.213 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -140.41 161.49 37.57 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.286 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . 0.402 ' HA ' ' HA ' ' A' ' 120' ' ' VAL . 40.2 ttp -115.39 148.87 38.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -130.21 133.61 46.68 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 176.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 52.7 mt -119.11 154.01 33.9 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.9 t -142.26 126.63 16.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.7 mt -84.45 170.91 13.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.452 . . . . 0.0 111.224 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -63.05 -2.17 1.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.56 1.944 . . . . 0.0 114.543 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -109.39 -10.29 14.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.89 1.676 . . . . 0.0 112.163 172.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.79 18.57 15.34 Favored Glycine 0 C--N 1.334 0.445 0 O-C-N 120.896 -1.128 . . . . 0.0 114.249 169.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.97 167.87 3.56 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.311 1.044 . . . . 0.0 110.982 174.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -139.66 104.15 4.85 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.348 -0.845 . . . . 0.0 109.059 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.745 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.6 OUTLIER -92.57 160.74 14.89 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.907 -1.12 . . . . 0.0 110.973 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . 0.401 ' O ' HD12 ' A' ' 30' ' ' LEU . 2.6 m -134.85 110.7 9.34 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 122.572 0.349 . . . . 0.0 111.201 -174.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 77.7 m-85 -114.06 140.98 48.02 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 123.972 0.795 . . . . 0.0 110.387 173.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -85.97 147.27 26.3 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 163.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -64.51 137.07 57.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 160.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 36.5 t -123.91 104.58 9.01 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 120.197 1.362 . . . . 0.0 107.99 163.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.3 t -123.12 17.59 9.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 123.489 0.493 . . . . 0.0 111.316 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? . . . . . 0 C--O 1.251 1.172 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 154.499 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 . . . . . 0 C--O 1.235 0.307 0 N-CA-C 110.704 -0.11 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -159.25 144.13 11.51 Favored Pre-proline 0 N--CA 1.468 0.47 0 O-C-N 121.301 -0.875 . . . . 0.0 111.583 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.79 -18.98 18.86 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.317 2.012 . . . . 0.0 111.942 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -13.32 23.62 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 119.23 0.923 . . . . 0.0 112.388 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.68 -25.64 49.68 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 119.726 1.148 . . . . 0.0 112.702 172.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -63.33 -31.02 72.07 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.822 0.849 . . . . 0.0 112.389 -160.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -21.8 66.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.753 0.706 . . . . 0.0 112.23 -175.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.0 mt -83.84 -9.43 58.77 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.449 1.1 . . . . 0.0 111.465 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.95 -13.52 62.49 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.813 0.845 . . . . 0.0 112.098 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -60.46 -9.82 4.15 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.801 2.04 . . . . 0.0 112.87 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -128.58 10.0 6.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.595 1.958 . . . . 0.0 111.483 -165.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.8 p -113.69 -174.76 2.53 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.463 -162.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -153.01 -66.58 0.16 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 118.211 -0.9 . . . . 0.0 112.186 -171.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.4 m95 65.88 171.29 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.91 1.284 . . . . 0.0 113.769 176.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.7 t -139.12 135.84 42.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 172.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.2 tp -74.44 143.24 44.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.83 -21.34 0.72 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 175.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -142.49 166.89 23.44 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 120.632 1.56 . . . . 0.0 111.388 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' ' CE1' ' A' ' 108' ' ' TYR . 5.9 t90 -150.65 101.48 2.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.06 2.144 . . . . 0.0 107.492 -176.02 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.6 145.11 25.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 170.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -88.44 172.31 9.46 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.386 0.674 . . . . 0.0 109.542 162.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.91 -34.48 73.25 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.273 1.029 . . . . 0.0 112.836 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.55 5.41 20.93 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.047 0.451 . . . . 0.0 110.823 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.61 11.66 60.41 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.221 1.391 . . . . 0.0 111.439 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 m -74.19 99.32 3.37 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 120.85 -1.383 . . . . 0.0 108.398 -174.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.5 104.36 1.24 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.158 0.98 . . . . 0.0 108.878 168.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 -59.4 157.5 11.01 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.78 1.232 . . . . 0.0 110.118 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.74 124.36 27.15 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.17 150.19 75.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.78 104.44 1.91 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.951 2.434 . . . . 0.0 110.179 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 169.26 11.24 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.006 1.322 . . . . 0.0 108.565 173.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.93 -46.43 71.53 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.786 -0.571 . . . . 0.0 111.618 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.34 -10.4 58.91 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -76.33 -12.04 60.0 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.851 0.86 . . . . 0.0 112.152 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.15 -32.97 4.54 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 124.337 0.97 . . . . 0.0 112.723 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.14 85.85 13.53 Favored Pre-proline 0 N--CA 1.449 -0.486 0 C-N-CA 125.993 1.717 . . . . 0.0 109.268 -171.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.3 132.8 32.69 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.76 1.64 . . . . 0.0 108.676 168.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.3 mt -69.99 98.95 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 O-C-N 121.913 -0.492 . . . . 0.0 109.821 173.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.9 p -75.9 154.0 36.32 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 171.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.67 155.04 39.85 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 172.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 17.6 m -141.9 137.4 31.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 85' ' ' LEU . 87.1 mt -128.99 60.4 1.55 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.272 1.429 . . . . 0.0 107.947 174.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.8 t -134.78 172.32 13.13 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.629 1.172 . . . . 0.0 108.238 -171.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -95.52 44.2 1.09 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.282 -1.511 . . . . 0.0 111.408 -160.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -13.38 6.04 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 p -121.18 0.03 10.04 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.158 2.183 . . . . 0.0 112.411 170.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.17 -39.79 2.66 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 127.991 2.71 . . . . 0.0 111.897 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -82.97 172.88 12.31 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.05 0.94 . . . . 0.0 108.691 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -75.87 76.47 2.79 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.956 0.884 . . . . 0.0 110.484 171.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -102.98 123.82 47.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.946 1.698 . . . . 0.0 106.992 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.96 144.49 31.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.872 1.669 . . . . 0.0 107.138 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.25 173.54 11.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 164.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.03 -168.72 38.57 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -135.02 95.19 3.26 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.0 m -73.66 77.37 1.52 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.054 1.341 . . . . 0.0 110.868 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.07 -63.57 1.65 Allowed Glycine 0 C--N 1.333 0.373 0 C-N-CA 125.003 1.287 . . . . 0.0 113.857 158.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.7 m -114.22 -16.95 11.97 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 119.509 1.655 . . . . 0.0 111.219 170.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.71 124.56 18.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 -157.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -73.9 162.66 28.85 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.822 1.296 . . . . 0.0 111.41 163.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -145.7 146.8 31.41 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 130.8 3.64 . . . . 0.0 107.049 -175.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 35.0 mtm -147.29 152.24 37.95 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.5 2.32 . . . . 0.0 106.404 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.23 175.22 34.86 Favored Glycine 0 C--N 1.32 -0.356 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.6 m -78.92 155.03 29.19 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.817 0.808 . . . . 0.0 111.168 -175.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 49.1 p90 -125.69 177.14 6.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.714 1.205 . . . . 0.0 110.558 167.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.4 153.49 34.81 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.099 1.76 . . . . 0.0 109.484 174.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.49 101.3 9.74 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 126.884 2.073 . . . . 0.0 105.666 178.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -154.8 158.88 40.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.487 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.0 t0 44.59 33.42 0.92 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.138 1.375 . . . . 0.0 114.692 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.41 ' O ' HG21 ' A' ' 118' ' ' THR . . . 65.39 5.14 20.56 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 118.171 -1.349 . . . . 0.0 114.808 -175.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -123.51 145.64 48.7 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 120.099 1.95 . . . . 0.0 110.986 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -71.82 119.9 16.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 169.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -123.98 152.44 42.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 119.037 0.835 . . . . 0.0 109.536 177.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.541 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.9 m-85 -119.59 175.15 5.99 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -172.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.16 -112.48 3.71 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 125.322 1.439 . . . . 0.0 110.458 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -132.08 70.9 1.46 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 127.996 2.519 . . . . 0.0 105.44 -163.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.751 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -71.57 151.77 43.52 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.26 -172.286 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.14 162.99 21.3 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 107.315 -2.314 . . . . 0.0 107.315 172.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.17 -27.19 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.42 0 C-N-CA 119.602 -1.285 . . . . 0.0 113.698 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.5 p -163.85 170.01 17.42 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.346 2.658 . . . . 0.0 109.272 -167.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -128.85 29.35 5.24 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.793 1.637 . . . . 0.0 110.334 -175.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.6 mtt -60.38 141.28 56.52 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 111.137 -168.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -105.57 124.68 49.95 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.227 1.411 . . . . 0.0 108.49 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 59.2 m -127.01 167.85 15.35 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.001 0.92 . . . . 0.0 109.893 168.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 mtp -120.56 47.01 1.87 Allowed 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 -177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.9 p -132.83 156.98 79.48 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.97 1.708 . . . . 0.0 108.128 177.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -60.24 -47.95 13.24 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.967 2.444 . . . . 0.0 110.819 174.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.24 -11.37 58.93 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.922 -0.932 . . . . 0.0 112.115 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.85 -60.22 2.48 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 119.148 1.474 . . . . 0.0 111.521 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -75.95 -18.07 59.48 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.528 1.164 . . . . 0.0 113.939 -168.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.6 tt -60.97 -21.03 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.155 0.982 . . . . 0.0 112.467 176.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -45.77 -46.11 15.06 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.149 1.78 . . . . 0.0 110.52 174.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -66.08 -34.96 89.83 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.77 -1.206 . . . . 0.0 113.042 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.15 75.46 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.691 1.746 . . . . 0.0 110.358 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . 0.476 ' CE1' ' CZ3' ' A' ' 33' ' ' TRP . 10.1 m-85 -60.31 -62.09 2.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.079 1.352 . . . . 0.0 109.782 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.86 -23.29 63.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.426 -173.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -61.78 -59.21 5.5 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 123.012 0.525 . . . . 0.0 110.199 168.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.56 -29.82 70.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.907 1.283 . . . . 0.0 110.902 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tp -56.59 -21.21 25.23 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.935 1.294 . . . . 0.0 112.992 -175.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -85.96 -23.19 27.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.423 1.465 . . . . 0.0 112.223 177.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -94.42 37.95 1.11 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.475 1.51 . . . . 0.0 111.338 -166.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.7 mm -75.96 79.92 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 174.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -79.69 -30.31 41.06 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.433 -0.792 . . . . 0.0 109.982 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.401 ' HE ' HG12 ' A' ' 131' ' ' VAL . 20.5 mtm180 -132.98 173.62 11.21 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 127.549 2.34 . . . . 0.0 109.434 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.41 HG21 ' O ' ' A' ' 83' ' ' GLY . 4.8 t -159.23 -179.49 8.03 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -172.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.48 84.57 0.08 OUTLIER Glycine 0 CA--C 1.53 0.978 0 C-N-CA 123.691 0.663 . . . . 0.0 112.046 171.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.293 1.7 p -88.88 120.96 38.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 119.101 1.45 . . . . 0.0 109.863 171.515 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -90.09 96.52 10.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 175.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 43.6 tpp -87.71 60.29 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.582 1.182 . . . . 0.0 108.181 177.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -153.38 135.95 15.16 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 171.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.31 92.89 Favored Pre-proline 0 N--CA 1.443 -0.822 0 CA-C-N 118.568 0.622 . . . . 0.0 110.212 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.5 119.05 3.65 Favored 'Cis proline' 0 N--CA 1.459 -0.536 0 CA-C-N 119.336 0.799 . . . . 0.0 110.262 -8.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -72.5 127.31 32.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 122.208 1.004 . . . . 0.0 108.514 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -142.77 159.68 41.77 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 126.209 1.804 . . . . 0.0 106.527 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.7 ttp -142.17 104.61 4.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -165.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -69.78 144.49 52.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 161.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.75 152.12 33.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 149.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.401 HG12 ' HE ' ' A' ' 117' ' ' ARG . 64.6 t -135.38 120.2 27.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.46 165.75 21.9 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.055 1.407 . . . . 0.0 111.079 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -53.94 -36.94 63.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.98 2.112 . . . . 0.0 111.273 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -81.82 -11.4 58.98 Favored 'General case' 0 C--O 1.226 -0.166 0 O-C-N 120.915 -1.116 . . . . 0.0 110.431 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.05 12.11 30.43 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 123.981 0.801 . . . . 0.0 113.902 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.18 166.19 5.08 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.172 1.486 . . . . 0.0 110.57 174.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.1 m -151.09 99.5 2.69 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 120.405 -1.434 . . . . 0.0 109.956 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -78.05 166.45 22.8 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 121.119 -0.988 . . . . 0.0 109.769 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 18.3 m -132.47 120.91 22.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -119.53 156.6 29.98 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.844 0.715 . . . . 0.0 110.09 168.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 131.09 53.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 126.863 2.065 . . . . 0.0 108.514 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.24 110.55 2.62 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.341 1.457 . . . . 0.0 110.427 -176.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.91 73.69 1.51 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 170.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.3 m -88.54 37.45 0.83 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 168.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.156 0 O-C-N 119.97 -1.706 . . . . 0.0 111.042 -172.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 121.719 0.771 . . . . 0.0 112.698 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -142.03 143.31 27.65 Favored Pre-proline 0 N--CA 1.457 -0.106 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.734 -173.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.24 -35.79 2.78 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.493 2.128 . . . . 0.0 111.212 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.48 72.96 1.01 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.523 1.929 . . . . 0.0 108.94 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.672 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -173.51 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 129.672 3.189 . . . . 0.0 108.037 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.5 m -63.31 -22.99 67.22 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.177 -0.952 . . . . 0.0 111.689 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -56.8 -15.99 5.75 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.499 1.12 . . . . 0.0 113.416 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.0 mt -98.42 5.14 48.35 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.683 1.193 . . . . 0.0 111.853 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.409 HD13 ' HE1' ' A' ' 28' ' ' TRP . 0.7 OUTLIER -75.11 75.01 2.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.939 1.696 . . . . 0.0 108.571 178.0 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -143.96 -29.29 0.5 Allowed 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 168.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -111.24 -5.52 14.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.892 1.277 . . . . 0.0 112.665 173.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.4 p -71.26 176.05 4.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.811 1.244 . . . . 0.0 110.814 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.3 OUTLIER -138.3 -64.67 0.52 Allowed 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 120.594 -1.316 . . . . 0.0 110.696 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.409 ' HE1' HD13 ' A' ' 23' ' ' LEU . 4.3 m95 67.77 163.01 0.2 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.974 1.71 . . . . 0.0 112.949 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -140.83 136.41 34.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 48.5 tp -85.26 135.58 33.86 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.92 -12.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 176.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.98 151.51 39.84 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.762 1.619 . . . . 0.0 111.714 172.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -142.17 101.16 3.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.31 1.844 . . . . 0.0 106.813 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.51 140.44 29.53 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.075 -1.016 . . . . 0.0 108.556 170.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.403 ' HA ' ' CG ' ' A' ' 136' ' ' ASP . 18.5 mt-30 -78.67 170.13 17.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.823 0.738 . . . . 0.0 111.542 166.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -21.8 38.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.313 2.245 . . . . 0.0 114.757 -177.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -111.08 1.86 17.59 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.528 1.058 . . . . 0.0 112.049 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 117.36 0.67 18.58 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.054 0.835 . . . . 0.0 113.795 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.2 m -67.62 95.29 0.47 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.156 1.478 . . . . 0.0 110.156 -175.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.35 107.08 1.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 O-C-N 120.16 -1.587 . . . . 0.0 111.091 171.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -65.72 159.9 24.06 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.974 1.709 . . . . 0.0 110.94 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.24 34.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 170.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.9 m -137.52 164.73 39.43 Favored Pre-proline 0 C--O 1.236 0.39 0 C-N-CA 123.824 0.85 . . . . 0.0 109.148 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 112.97 3.6 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 121.947 1.765 . . . . 0.0 110.478 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -64.74 178.09 0.84 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.151 0.981 . . . . 0.0 110.245 162.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.76 99.8 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.396 -0.815 . . . . 0.0 110.241 165.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -32.24 73.8 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.332 1.453 . . . . 0.0 110.91 -174.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -59.5 -12.99 7.28 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.219 1.808 . . . . 0.0 113.479 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -45.16 1.36 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 124.098 0.856 . . . . 0.0 111.563 165.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.88 77.89 75.98 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.447 1.499 . . . . 0.0 109.087 -175.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.22 154.72 69.44 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 124.569 3.513 . . . . 0.0 112.138 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.45 100.07 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.051 0.94 . . . . 0.0 108.472 171.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.3 p -92.14 154.78 18.48 Favored 'General case' 0 C--O 1.241 0.647 0 O-C-N 121.816 -0.552 . . . . 0.0 110.068 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -121.28 155.33 34.91 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.068 1.747 . . . . 0.0 106.882 173.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 8.9 m -147.78 99.48 3.1 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.568 -0.707 . . . . 0.0 109.667 176.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.89 125.35 29.14 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.06 -164.34 1.59 Allowed 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 p -139.16 24.15 2.54 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.737 2.815 . . . . 0.0 110.679 -169.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.9 p -68.62 0.44 4.15 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -167.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.0 p -117.5 1.5 12.32 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.962 1.705 . . . . 0.0 110.933 171.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.4 -48.35 0.95 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 127.447 2.451 . . . . 0.0 110.564 -176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -93.26 170.68 9.44 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.751 1.62 . . . . 0.0 109.157 -169.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -73.55 101.44 3.57 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -124.23 141.95 51.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.12 100.59 10.06 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 126.364 1.866 . . . . 0.0 106.715 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.2 t -108.35 148.43 30.09 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 164.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.38 -162.13 12.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 106.799 -2.52 . . . . 0.0 106.799 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HB3' ' A' ' 73' ' ' ARG . 77.0 t80 -108.37 -11.99 15.11 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -171.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.2 m 51.52 -164.96 0.05 Allowed 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 129.886 3.274 . . . . 0.0 111.601 -172.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.49 -30.23 33.39 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.444 1.497 . . . . 0.0 113.247 172.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.0 t -174.91 0.06 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.486 0.715 . . . . 0.0 112.258 162.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -125.68 102.74 7.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 123.665 1.698 . . . . 0.0 109.575 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HB3' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -55.5 132.44 48.49 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.945 -171.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.07 165.14 12.65 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 128.153 2.581 . . . . 0.0 109.446 -164.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.5 mtm -152.45 156.59 39.77 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.512 -2.033 . . . . 0.0 105.512 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.69 175.83 30.06 Favored Glycine 0 C--N 1.318 -0.44 0 C-N-CA 124.607 1.099 . . . . 0.0 110.397 173.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.4 m -87.48 165.24 15.67 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 122.092 -0.652 . . . . 0.0 110.927 -173.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -145.96 178.33 8.27 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -159.07 155.89 28.21 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.073 1.749 . . . . 0.0 109.569 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mp -112.31 127.08 55.89 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 125.512 1.525 . . . . 0.0 107.754 175.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 169.36 15.01 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 124.795 1.238 . . . . 0.0 109.317 171.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.6 t0 44.66 44.88 7.77 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.739 1.616 . . . . 0.0 113.477 168.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.82 0.66 5.39 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 115.585 0.994 . . . . 0.0 115.585 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -127.33 172.2 10.84 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 126.227 1.811 . . . . 0.0 112.013 -166.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.03 103.31 9.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -174.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -90.86 151.51 21.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.47 ' HB3' HD21 ' A' ' 90' ' ' LEU . 82.5 m-85 -118.08 -179.83 3.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 123.485 0.714 . . . . 0.0 110.698 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -107.61 -105.32 3.0 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 176.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 m -140.91 71.62 1.37 Allowed 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 -169.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.626 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -63.33 167.04 5.64 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.528 0.68 . . . . 0.0 111.033 -177.698 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.79 170.95 26.08 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 107.711 -2.155 . . . . 0.0 107.711 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -155.42 -156.08 7.62 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -160.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.4 p -76.88 -179.69 5.61 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 122.255 -0.556 . . . . 0.0 109.622 165.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -133.68 86.98 2.33 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 163.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 10.0 mtt -80.52 154.46 27.51 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.47 140.39 58.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 159.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 98.9 m -142.71 -19.27 0.67 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.481 1.113 . . . . 0.0 113.392 172.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.0 mtm 62.18 25.57 15.31 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.38 1.072 . . . . 0.0 113.739 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -123.81 161.56 45.81 Favored Pre-proline 0 C--O 1.24 0.562 0 C-N-CA 125.909 1.683 . . . . 0.0 110.233 -176.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.27 -33.0 19.42 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.68 2.253 . . . . 0.0 111.231 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -60.14 -33.75 81.07 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.967 0.794 . . . . 0.0 111.524 172.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.92 -43.19 99.65 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 118.076 0.938 . . . . 0.0 112.42 172.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -85.85 -33.25 21.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.138 0.969 . . . . 0.0 112.895 -170.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 17.6 tt -61.01 -18.29 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 118.819 0.736 . . . . 0.0 111.599 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -56.96 -36.21 70.02 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 121.352 -0.842 . . . . 0.0 111.858 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.86 -26.55 60.7 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.282 -0.732 . . . . 0.0 112.414 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.26 -40.17 15.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 118.697 1.249 . . . . 0.0 110.601 173.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -30.54 57.07 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 -158.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.1 mt -60.41 -38.94 85.6 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.808 1.243 . . . . 0.0 110.068 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -36.95 67.34 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 122.782 0.433 . . . . 0.0 110.361 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.95 66.09 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 122.083 -0.385 . . . . 0.0 111.288 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.88 -7.32 39.25 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.12 -0.943 . . . . 0.0 113.349 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.7 p -94.77 -11.68 28.54 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 120.789 1.631 . . . . 0.0 112.317 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -113.54 35.31 4.08 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.169 0.987 . . . . 0.0 110.782 -172.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 mm -72.15 72.96 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -75.92 -35.15 59.86 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 169.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -127.54 160.71 30.69 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.138 0.975 . . . . 0.0 110.731 -173.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -151.35 158.11 43.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.604 1.162 . . . . 0.0 107.961 169.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.51 108.37 0.44 Allowed Glycine 0 N--CA 1.441 -1.018 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 172.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.4 p -108.5 156.19 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 118.936 1.368 . . . . 0.0 111.174 169.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -136.92 112.07 9.06 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 39.5 ttm -108.45 66.99 0.65 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.514 1.526 . . . . 0.0 109.385 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -152.69 80.6 1.22 Allowed 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.789 1.236 . . . . 0.0 109.458 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -27.88 119.94 0.26 Allowed Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 127.697 2.399 . . . . 0.0 112.437 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.56 122.72 8.81 Favored 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.317 0.792 . . . . 0.0 111.758 15.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -83.28 141.91 31.49 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -172.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -141.53 170.13 16.31 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 161.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -143.22 142.34 31.38 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 127.732 2.413 . . . . 0.0 105.226 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.15 129.08 33.27 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 -174.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 97.1 mt -103.86 140.4 37.72 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.7 t -127.22 123.67 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.94 165.2 25.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -59.66 -33.15 71.18 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.578 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.05 -21.88 39.74 Favored 'General case' 0 C--N 1.341 0.207 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.406 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.15 6.45 12.26 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.37 -1.239 . . . . 0.0 115.407 168.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 35' ' ' GLN . 1.4 m-20 -61.68 133.64 55.83 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.587 2.193 . . . . 0.0 108.72 174.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.4 m -116.33 103.36 10.4 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.845 2.058 . . . . 0.0 108.265 -169.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.8 mp -94.55 114.18 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 51.1 m -86.03 124.31 32.32 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 170.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -99.35 163.4 12.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.484 1.514 . . . . 0.0 108.621 167.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.38 147.64 34.76 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.089 1.756 . . . . 0.0 108.279 163.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.2 tpt85 -81.15 109.41 15.67 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.8 t -91.27 108.52 19.94 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 105.03 -2.211 . . . . 0.0 105.03 163.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.77 16.77 17.33 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.693 2.397 . . . . 0.0 110.69 165.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.188 0 CA-C-O 116.52 -1.705 . . . . 0.0 107.126 164.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 . . . . . 0 C--O 1.237 0.418 0 CA-C-O 121.685 0.755 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -94.25 144.63 28.33 Favored Pre-proline 0 C--O 1.232 0.152 0 CA-C-N 115.378 -0.828 . . . . 0.0 113.128 -166.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.1 -28.47 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.669 2.246 . . . . 0.0 111.689 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.78 -21.14 64.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.77 0.828 . . . . 0.0 112.934 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.513 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.96 -16.67 57.98 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.221 -0.925 . . . . 0.0 111.71 176.135 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.536 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.2 t -72.79 -21.01 61.06 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.842 1.201 . . . . 0.0 110.451 -168.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLN . . . . . 0.413 HE21 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -75.76 3.4 9.9 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 120.01 -1.681 . . . . 0.0 110.743 -177.148 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -121.56 29.2 7.31 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.095 2.158 . . . . 0.0 109.348 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 120' ' ' VAL . 3.8 mm? -103.09 74.1 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.905 2.082 . . . . 0.0 105.896 167.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.256 2.0 p30 -129.44 -62.54 0.97 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.353 -172.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 2.12 45.2 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.415 1.486 . . . . 0.0 110.804 171.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.99 162.18 29.84 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.698 1.999 . . . . 0.0 109.57 -171.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.1 m -156.08 144.12 19.75 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 118.589 -2.569 . . . . 0.0 107.701 -173.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TRP . . . . . 0.468 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 28.2 m95 -149.02 175.79 11.0 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 124.171 0.92 . . . . 0.0 112.192 -161.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.597 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.6 p -153.65 118.63 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 174.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.587 HD11 HD12 ' A' ' 138' ' ' LEU . 7.5 tp -60.41 139.12 57.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.124 -175.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 t -145.63 -2.17 0.76 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 113.274 171.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.43 157.35 42.93 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.036 1.289 . . . . 0.0 110.281 168.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TRP . . . . . 0.551 ' CD1' HD21 ' A' ' 138' ' ' LEU . 2.2 t90 -152.56 100.39 2.55 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 127.098 2.159 . . . . 0.0 105.829 172.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.66 142.84 27.93 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -81.99 170.94 14.99 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 164.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.26 72.36 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 123.574 0.546 . . . . 0.0 111.502 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -86.08 3.13 43.87 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.802 1.641 . . . . 0.0 112.054 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.93 1.14 57.29 Favored Glycine 0 CA--C 1.524 0.605 0 O-C-N 120.746 -1.222 . . . . 0.0 112.789 167.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.4 m -67.01 95.74 0.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 126.344 1.857 . . . . 0.0 109.407 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.77 112.4 2.01 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.958 -1.089 . . . . 0.0 109.759 165.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -71.7 149.6 45.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.378 1.071 . . . . 0.0 109.507 176.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.49 105.73 15.53 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 124.364 1.066 . . . . 0.0 109.164 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.9 m -113.51 152.26 45.19 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 125.872 1.669 . . . . 0.0 107.207 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -73.97 120.08 6.18 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 121.887 1.724 . . . . 0.0 109.034 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.24 171.11 13.61 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.216 0.606 . . . . 0.0 110.119 171.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -38.69 77.28 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 121.895 -0.503 . . . . 0.0 110.459 169.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -9.5 58.66 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -81.57 -29.69 33.31 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.864 0.866 . . . . 0.0 111.803 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.51 -80.01 0.24 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -170.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.07 85.23 58.24 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.163 1.385 . . . . 0.0 110.137 -168.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.47 152.44 75.1 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.187 1.925 . . . . 0.0 111.036 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.1 mt -78.03 101.7 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.9 177.78 6.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.225 1.375 . . . . 0.0 108.5 174.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HG ' ' CE2' ' A' ' 140' ' ' PHE . 1.4 tm? -144.23 146.85 32.92 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 127.031 2.133 . . . . 0.0 106.966 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -145.29 143.52 30.25 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 105.917 -1.882 . . . . 0.0 105.917 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.03 128.96 41.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 172.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -159.8 177.75 10.5 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -129.43 24.03 5.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.121 0.968 . . . . 0.0 112.574 -171.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.79 -31.44 11.67 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.1 p -92.95 8.05 41.42 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.123 177.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.83 -0.46 51.15 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.21 1.386 . . . . 0.0 111.908 -166.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -117.89 161.6 19.49 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 126.037 1.735 . . . . 0.0 108.622 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -75.56 63.47 1.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 124.709 1.203 . . . . 0.0 109.832 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.96 110.64 18.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 120.801 1.637 . . . . 0.0 110.187 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.66 152.5 27.09 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.668 -1.605 . . . . 0.0 107.257 159.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.5 p -141.94 -177.88 5.42 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 125.092 1.357 . . . . 0.0 107.964 161.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.16 168.39 39.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 163.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.461 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 5.7 t80 -89.75 138.35 31.56 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 160.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.5 t -118.71 71.44 0.85 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.01 -36.21 0.4 Allowed Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.975 2.226 . . . . 0.0 116.982 167.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 7.6 t -146.49 -14.26 0.44 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.199 1.399 . . . . 0.0 111.893 163.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -130.06 115.52 17.22 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -64.5 162.46 15.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.519 164.363 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -139.09 168.45 19.81 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 125.341 1.457 . . . . 0.0 109.223 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.8 ptp -152.16 172.81 15.79 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.098 2.159 . . . . 0.0 108.185 170.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.3 -143.62 7.52 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.654 -2.178 . . . . 0.0 107.654 168.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.1 m -125.26 161.23 27.4 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 119.281 1.541 . . . . 0.0 112.777 165.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -128.62 173.62 10.13 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.228 1.011 . . . . 0.0 111.847 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -154.22 139.89 17.98 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.373 1.069 . . . . 0.0 110.349 -176.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.26 120.6 42.27 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 168.45 22.74 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.535 1.534 . . . . 0.0 109.226 169.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t0 48.31 39.06 11.55 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.065 1.346 . . . . 0.0 113.713 167.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.3 13.14 48.32 Favored Glycine 0 CA--C 1.535 1.291 0 O-C-N 120.233 -1.542 . . . . 0.0 114.56 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -134.65 164.8 26.7 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 119.244 1.522 . . . . 0.0 113.01 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.0 tp -109.92 96.83 6.5 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.693 1.597 . . . . 0.0 106.812 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.3 m -87.43 162.3 17.36 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.419 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.3 m-85 -139.3 155.92 47.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.773 1.629 . . . . 0.0 109.166 -176.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.11 -106.6 0.15 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 170.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -143.83 58.84 1.37 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.232 1.015 . . . . 0.0 108.465 -154.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.706 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -60.45 153.11 23.94 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 121.142 -0.974 . . . . 0.0 112.913 -165.805 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.78 173.1 45.42 Favored Glycine 0 N--CA 1.453 -0.201 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -147.54 -117.29 0.97 Allowed Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.3 p -120.82 178.25 4.78 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.689 1.196 . . . . 0.0 110.928 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.6 mtt85 -113.43 73.51 0.82 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.274 1.03 . . . . 0.0 108.68 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtt -74.58 176.99 6.37 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.038 -1.039 . . . . 0.0 109.342 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.43 147.74 52.39 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.55 1.14 . . . . 0.0 109.679 173.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 9.9 m -136.41 -12.62 1.83 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.17 1.788 . . . . 0.0 114.211 177.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 66.03 22.11 11.22 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.856 1.663 . . . . 0.0 113.36 176.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.2 p -110.41 165.3 12.93 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 124.009 0.924 . . . . 0.0 111.191 -165.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.92 -11.46 25.6 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.533 2.155 . . . . 0.0 112.768 164.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -93.05 -9.82 60.37 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-N 118.983 0.811 . . . . 0.0 112.881 168.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.11 -53.44 9.21 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 119.19 1.495 . . . . 0.0 112.487 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -88.2 -16.18 34.0 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -167.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.99 -17.98 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.296 170.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -44.75 -55.18 5.53 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.002 1.321 . . . . 0.0 110.06 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.63 -6.14 70.6 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.002 -0.888 . . . . 0.0 113.742 -173.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -87.08 -51.79 5.8 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.835 1.817 . . . . 0.0 109.005 162.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.84 -47.62 76.91 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.799 1.24 . . . . 0.0 111.416 -171.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.98 -44.39 91.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.059 0.391 . . . . 0.0 110.388 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.44 -34.09 76.1 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.548 0.739 . . . . 0.0 111.624 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.14 59.89 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.95 0.9 . . . . 0.0 112.564 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -72.94 -8.21 54.6 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.475 1.034 . . . . 0.0 112.257 172.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 13.7 p -83.75 -5.07 59.11 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.191 -0.943 . . . . 0.0 111.768 175.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -127.33 83.33 2.16 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.064 2.146 . . . . 0.0 107.283 -169.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -122.18 59.41 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.228 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.41 -22.88 62.68 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.895 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -135.09 165.76 24.62 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.767 1.627 . . . . 0.0 111.095 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 11.2 m -159.93 170.17 21.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.757 1.623 . . . . 0.0 109.019 176.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.06 83.42 0.13 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 125.01 1.29 . . . . 0.0 110.037 168.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 23' ' ' LEU . 2.4 p -81.3 151.48 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.475 1.637 . . . . 0.0 109.898 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -127.0 90.84 3.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.701 1.6 . . . . 0.0 107.603 175.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 35.2 ttm -77.72 73.29 4.29 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.292 1.044 . . . . 0.0 109.25 169.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -151.45 143.42 23.88 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.574 -2.009 . . . . 0.0 105.574 162.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.07 133.44 95.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 119.72 1.145 . . . . 0.0 108.732 173.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -75.49 117.76 4.96 Favored 'Cis proline' 0 N--CA 1.455 -0.781 0 CA-C-N 120.289 1.139 . . . . 0.0 110.923 -2.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -71.21 132.51 45.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -172.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -144.08 163.23 34.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.234 1.014 . . . . 0.0 108.636 173.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.0 ttp -126.44 115.45 19.62 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -86.31 148.7 25.49 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 158.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.47 155.31 45.02 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 126.147 1.779 . . . . 0.0 106.455 167.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.2 t -141.45 125.67 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -174.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.14 165.6 24.67 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.11 -30.77 38.4 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 125.985 1.714 . . . . 0.0 111.843 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.14 -37.77 69.36 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.2 1.0 . . . . 0.0 109.019 -176.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.15 13.56 4.85 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.938 1.256 . . . . 0.0 113.873 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.12 156.36 5.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.174 1.987 . . . . 0.0 110.204 174.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.8 m -126.45 97.62 5.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.0 162.11 19.49 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.257 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 88.2 m -152.94 133.06 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.124 0.57 . . . . 0.0 109.565 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' PHE . . . . . 0.427 ' CE2' ' HG ' ' A' ' 54' ' ' LEU . 2.1 m-85 -126.31 156.01 41.08 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.597 1.559 . . . . 0.0 110.689 -176.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ASP . . . . . 0.597 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -91.62 156.85 17.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 117.12 -1.419 . . . . 0.0 107.279 176.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -81.82 91.94 6.59 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 122.613 2.461 . . . . 0.0 109.706 163.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 26.6 t -81.72 90.18 6.33 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 166.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 t -91.02 1.83 56.78 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 175.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 129.752 3.221 . . . . 0.0 114.035 -174.261 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 56.5 mt . . . . . 0 N--CA 1.472 0.635 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.86 -170.54 0.47 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.299 2.666 . . . . 0.0 109.912 167.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.5 170.89 11.14 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 121.619 -0.676 . . . . 0.0 110.204 173.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -53.85 160.79 1.97 Allowed Pre-proline 0 CA--C 1.544 0.747 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.796 152.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -75.93 -14.99 19.01 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.582 2.855 . . . . 0.0 114.052 -177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 66.9 178.39 0.23 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 127.484 2.314 . . . . 0.0 110.669 -164.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 32.4 t -98.35 109.47 22.22 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 127.126 2.171 . . . . 0.0 110.243 -171.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -136.63 45.83 2.27 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 121.882 0.849 . . . . 0.0 112.327 171.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -150.58 110.01 3.99 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.119 -0.988 . . . . 0.0 109.091 -178.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.6 t -134.71 97.42 2.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 171.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -164.9 156.23 13.1 Favored Pre-proline 0 C--O 1.239 0.504 0 O-C-N 121.425 -0.797 . . . . 0.0 111.539 176.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.24 161.85 32.45 Favored 'Trans proline' 0 CA--C 1.534 0.523 0 C-N-CA 123.72 2.947 . . . . 0.0 111.728 176.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.8 158.61 70.39 Favored Pre-proline 0 C--O 1.242 0.663 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 -175.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -73.84 -173.05 1.25 Allowed 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 124.065 3.177 . . . . 0.0 111.838 -171.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 64.19 -178.25 0.16 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.664 1.586 . . . . 0.0 110.376 -177.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -161.52 143.36 8.76 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 124.591 1.156 . . . . 0.0 108.916 178.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -80.95 -31.83 1.23 Allowed 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 123.714 2.943 . . . . 0.0 111.844 -178.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.2 56.8 0.47 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.349 1.059 . . . . 0.0 110.707 172.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.574 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -154.56 -41.18 0.09 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 129.69 3.196 . . . . 0.0 107.024 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -68.13 21.45 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.018 1.327 . . . . 0.0 113.766 177.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -120.34 1.48 10.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.668 2.787 . . . . 0.0 111.428 175.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mp -113.2 2.27 15.54 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 129.199 3.0 . . . . 0.0 109.341 175.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.592 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.5 mm? -81.51 67.71 7.57 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.628 1.571 . . . . 0.0 107.891 -178.104 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -134.57 -48.52 0.76 Allowed 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 122.975 0.51 . . . . 0.0 111.032 -173.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -122.12 65.75 0.92 Allowed 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 105.988 -1.856 . . . . 0.0 105.988 177.13 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 73.4 p -135.67 171.09 14.95 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.229 1.012 . . . . 0.0 109.592 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 61.5 m -156.12 148.91 24.01 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 119.335 -2.103 . . . . 0.0 107.557 -178.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -158.67 154.46 26.46 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -161.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -134.93 129.22 50.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -76.81 130.28 37.44 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 106.174 -1.788 . . . . 0.0 106.174 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -123.05 -16.39 7.03 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -156.58 147.29 21.74 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 119.423 1.01 . . . . 0.0 108.917 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.6 t90 -135.67 115.2 12.71 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.989 -1.486 . . . . 0.0 106.989 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.32 145.69 27.83 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.088 0.955 . . . . 0.0 109.453 174.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -79.45 167.07 21.31 Favored 'General case' 0 N--CA 1.443 -0.791 0 C-N-CA 122.918 0.487 . . . . 0.0 110.333 172.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.68 -33.69 70.43 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.632 0.773 . . . . 0.0 112.909 -175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -85.39 -30.25 23.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 120.32 -0.552 . . . . 0.0 111.23 177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 139.59 -0.74 2.25 Favored Glycine 0 CA--C 1.534 1.236 0 CA-C-O 118.434 -1.203 . . . . 0.0 115.065 176.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.5 m -64.79 108.64 1.8 Allowed 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 120.822 2.311 . . . . 0.0 109.758 176.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.53 110.13 1.38 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 123.037 0.535 . . . . 0.0 109.737 165.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 42.7 mtt-85 -63.72 171.69 2.56 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 125.15 1.38 . . . . 0.0 110.106 173.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -97.84 127.08 43.55 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 173.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.4 m -129.8 155.23 80.79 Favored Pre-proline 0 CA--C 1.536 0.435 0 C-N-CA 123.605 0.762 . . . . 0.0 109.566 -179.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -74.35 103.48 1.69 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 122.62 2.213 . . . . 0.0 110.257 178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.2 m -61.1 158.25 14.14 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 166.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.7 -17.13 62.67 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 124.172 0.989 . . . . 0.0 113.467 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -72.39 -12.07 60.96 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.641 0.655 . . . . 0.0 112.662 174.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.0 -22.04 18.8 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.891 0.876 . . . . 0.0 112.889 -165.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.39 -9.42 8.28 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 116.348 1.299 . . . . 0.0 116.348 164.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -157.78 76.21 3.83 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 126.418 1.887 . . . . 0.0 110.031 176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -67.93 160.97 46.11 Favored 'Trans proline' 0 C--O 1.238 0.5 0 C-N-CA 123.897 3.065 . . . . 0.0 111.678 -178.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 55.0 mt -89.23 107.01 17.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 124.077 0.951 . . . . 0.0 109.313 -179.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.1 p -112.39 154.33 25.94 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.914 1.286 . . . . 0.0 109.596 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -131.22 143.07 50.31 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 127.724 2.41 . . . . 0.0 106.627 174.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 43.2 m -137.3 128.57 27.97 Favored 'General case' 0 N--CA 1.441 -0.908 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 177.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 68.0 mt -120.09 118.56 30.9 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 104.858 -2.275 . . . . 0.0 104.858 176.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.9 t -168.71 168.36 10.74 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 106.542 -1.651 . . . . 0.0 106.542 175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.8 p -75.29 48.66 0.43 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.051 0.94 . . . . 0.0 110.636 168.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -69.93 -20.66 63.34 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.572 1.149 . . . . 0.0 112.402 -171.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.2 p -98.21 -0.02 44.94 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.54 1.136 . . . . 0.0 111.459 171.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.44 -17.16 57.09 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.972 1.748 . . . . 0.0 111.955 -161.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -122.51 170.19 10.24 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.901 1.85 . . . . 0.0 110.87 -175.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -71.53 81.46 0.81 Allowed 'General case' 0 C--O 1.233 0.202 0 C-N-CA 123.725 0.81 . . . . 0.0 109.913 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -126.32 113.4 16.88 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.86 1.264 . . . . 0.0 107.69 -170.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.64 148.63 51.64 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 113.842 -1.526 . . . . 0.0 107.534 169.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.5 p -147.19 165.67 29.31 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 125.084 1.354 . . . . 0.0 107.744 172.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 165.53 -174.75 41.32 Favored Glycine 0 N--CA 1.45 -0.396 0 N-CA-C 110.608 -0.997 . . . . 0.0 110.608 177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -122.66 113.98 19.97 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.3 m -125.57 94.41 4.13 Favored 'General case' 0 CA--C 1.516 -0.36 0 O-C-N 123.685 0.616 . . . . 0.0 110.535 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 111.0 -101.93 1.4 Allowed Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 108.077 -2.009 . . . . 0.0 108.077 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -138.07 25.98 2.72 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 118.819 1.31 . . . . 0.0 111.187 164.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -140.79 128.48 21.57 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 -170.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -73.42 147.83 43.86 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.803 -0.561 . . . . 0.0 110.304 175.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -123.72 169.32 11.63 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 125.143 1.377 . . . . 0.0 110.373 176.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -161.17 169.13 22.89 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.953 1.701 . . . . 0.0 109.189 176.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.21 173.62 25.0 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.642 1.591 . . . . 0.0 110.127 166.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 53.5 p -79.46 165.45 23.04 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.275 1.038 . . . . 0.0 111.021 -176.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.3 p90 -140.34 174.54 10.41 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.154 0.582 . . . . 0.0 111.449 172.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.73 150.82 26.61 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.612 1.565 . . . . 0.0 109.072 174.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -109.67 128.55 55.33 Favored 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 123.887 0.875 . . . . 0.0 108.829 179.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.7 ptpt -164.14 162.22 22.71 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 126.35 1.86 . . . . 0.0 109.002 173.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 52.2 22.55 1.99 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.579 2.352 . . . . 0.0 114.749 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.62 12.79 84.11 Favored Glycine 0 CA--C 1.525 0.684 0 CA-C-O 118.388 -1.229 . . . . 0.0 112.973 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 pttm -124.98 171.01 10.56 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.588 1.555 . . . . 0.0 112.47 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.583 ' O ' HG21 ' A' ' 115' ' ' ILE . 50.7 tp -109.94 100.14 9.14 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.832 1.653 . . . . 0.0 107.237 175.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.2 m -79.22 155.98 28.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 171.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.471 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.7 m-85 -120.36 159.13 25.67 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.44 0.696 . . . . 0.0 109.802 173.177 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.9 -155.95 30.84 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.7 m -63.17 95.6 0.09 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.523 1.129 . . . . 0.0 108.965 166.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 112' ' ' LEU . 19.5 mt -79.41 175.46 10.58 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 126.281 1.832 . . . . 0.0 110.571 168.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.88 177.33 33.9 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 168.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.25 -132.18 1.97 Allowed Glycine 0 CA--C 1.522 0.508 0 CA-C-O 118.234 -1.314 . . . . 0.0 110.291 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.3 p -143.78 156.2 44.42 Favored 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.147 1.779 . . . . 0.0 111.032 -173.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? -103.55 61.29 0.76 Allowed 'General case' 0 C--O 1.237 0.417 0 CA-C-O 122.146 0.974 . . . . 0.0 108.526 -163.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 18.7 mtm -71.03 172.12 9.66 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 167.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -131.73 124.81 30.52 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.544 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.279 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 6.3 m -118.16 8.39 12.35 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 117.317 -1.325 . . . . 0.0 113.067 175.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 25.4 ptp 44.67 41.14 4.66 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.208 1.803 . . . . 0.0 113.869 173.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.01 156.15 65.26 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 124.09 0.956 . . . . 0.0 109.838 -167.121 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -71.24 -36.92 6.47 Favored 'Trans proline' 0 N--CA 1.453 -0.863 0 C-N-CA 123.211 2.608 . . . . 0.0 110.924 177.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -80.26 -3.97 89.82 Favored Glycine 0 C--O 1.219 -0.834 0 CA-C-O 117.436 -1.758 . . . . 0.0 111.289 174.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.42 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -85.47 -61.06 1.74 Allowed Glycine 0 C--N 1.341 0.82 0 CA-C-N 120.897 2.349 . . . . 0.0 111.888 170.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -62.99 -18.4 63.24 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 -172.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -61.26 -8.01 1.88 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 118.545 -0.74 . . . . 0.0 111.976 -178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -44.42 -48.73 9.92 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 119.276 0.944 . . . . 0.0 111.073 162.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.94 -52.38 52.61 Favored Glycine 0 C--N 1.337 0.595 0 N-CA-C 110.714 -0.954 . . . . 0.0 110.714 -175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -61.82 -43.95 97.83 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.517 0.727 . . . . 0.0 110.631 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 43.9 t80 -62.17 -48.43 80.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 124.29 1.036 . . . . 0.0 109.944 -173.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 31.0 mt -59.83 -37.21 78.57 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.312 0.505 . . . . 0.0 110.741 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -16.75 64.38 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 113.58 0.956 . . . . 0.0 113.58 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -97.34 -7.17 32.58 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 125.064 1.345 . . . . 0.0 111.618 175.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.617 HD13 HD13 ' A' ' 90' ' ' LEU . 91.0 mt -83.67 -13.39 54.25 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 120.181 1.355 . . . . 0.0 111.66 173.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.15 -5.06 59.13 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.43 1.092 . . . . 0.0 113.445 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -134.33 78.58 1.76 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.421 1.089 . . . . 0.0 108.408 -171.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.583 HG21 ' O ' ' A' ' 85' ' ' LEU . 27.5 mm -103.71 35.6 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 125.081 1.352 . . . . 0.0 110.337 -172.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.01 -23.35 67.18 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 119.527 -1.983 . . . . 0.0 113.605 -164.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.7 mtp180 -124.5 158.3 33.23 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 125.156 1.382 . . . . 0.0 109.025 170.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 51.6 m -155.56 124.83 6.25 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.051 -1.031 . . . . 0.0 110.943 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -101.61 131.15 10.48 Favored Glycine 0 CA--C 1.532 1.122 0 C-N-CA 127.311 2.386 . . . . 0.0 110.383 171.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' A' ' 19' ' ' ALA . 1.7 p -137.48 138.29 44.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 O-C-N 120.223 -1.751 . . . . 0.0 107.974 159.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.85 97.25 5.74 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 106.668 -1.605 . . . . 0.0 106.668 169.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.505 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 29.7 mtp -76.73 -5.51 48.37 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 127.06 30.29 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.578 1.551 . . . . 0.0 108.599 158.431 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -80.0 137.97 53.39 Favored Pre-proline 0 N--CA 1.445 -0.72 0 N-CA-C 107.323 -1.362 . . . . 0.0 107.323 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -83.45 110.21 1.77 Allowed 'Cis proline' 0 CA--C 1.536 0.615 0 CA-C-N 120.615 1.255 . . . . 0.0 111.675 9.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' A' ' 122' ' ' MET . 79.7 mt-30 -68.66 129.67 40.62 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 124.93 1.292 . . . . 0.0 111.374 -164.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -141.26 112.1 7.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.549 0.69 . . . . 0.0 109.449 173.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 56.4 ttp -75.96 157.09 33.54 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 175.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -146.1 112.0 5.66 Favored 'General case' 0 N--CA 1.443 -0.781 0 O-C-N 121.381 -0.824 . . . . 0.0 109.596 177.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 79.2 mt -86.72 156.78 19.82 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 93.1 t -142.72 137.81 27.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -177.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.49 167.35 10.67 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 21.9 p-10 -62.08 -19.92 63.45 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.008 1.323 . . . . 0.0 113.327 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 78.4 m-20 -75.33 -32.55 60.96 Favored 'General case' 0 CA--C 1.522 -0.115 0 CA-C-N 119.003 0.82 . . . . 0.0 109.865 172.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.63 0.51 20.04 Favored Glycine 0 CA--C 1.528 0.89 0 CA-C-O 117.84 -1.534 . . . . 0.0 113.425 -165.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -61.37 159.07 13.18 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 120.025 1.913 . . . . 0.0 108.784 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 1.1 m -138.45 141.07 39.5 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 119.666 1.121 . . . . 0.0 109.088 -170.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.8 mp -132.78 111.39 11.07 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 120.423 -1.423 . . . . 0.0 108.179 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.3 m -88.47 118.65 28.26 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 124.94 1.296 . . . . 0.0 110.238 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 42.0 m-85 -110.25 139.77 45.09 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 123.891 0.876 . . . . 0.0 110.742 176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.99 153.99 33.97 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 160.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.4 tpt180 -69.75 147.49 50.41 Favored 'General case' 0 N--CA 1.462 0.158 0 N-CA-C 106.374 -1.713 . . . . 0.0 106.374 158.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 1.6 t -138.81 101.39 4.3 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 165.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 3.2 p -81.31 -5.27 57.64 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -176.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.5 ttt85 . . . . . 0 C--O 1.254 1.301 0 CA-C-O 117.105 -1.426 . . . . 0.0 111.144 -142.178 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.465 0.296 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -69.67 158.49 56.89 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.547 2.165 . . . . 0.0 110.374 168.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.8 mtmt 174.57 167.52 0.25 Allowed 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 130.735 3.614 . . . . 0.0 105.789 167.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.1 m80 63.3 166.62 0.11 Allowed Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 123.972 0.909 . . . . 0.0 112.099 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -67.89 78.53 0.55 Allowed 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.087 1.858 . . . . 0.0 108.304 166.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -144.15 -174.47 4.29 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.003 1.721 . . . . 0.0 107.877 -167.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 71.0 p -79.85 -166.77 1.07 Allowed 'General case' 0 CA--C 1.544 0.712 0 O-C-N 120.993 -1.067 . . . . 0.0 113.159 -173.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 65.99 29.68 10.04 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.211 1.804 . . . . 0.0 113.758 -177.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -124.11 39.7 3.91 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.132 0.973 . . . . 0.0 112.622 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.4 p -142.62 129.82 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 N-CA-C 104.625 -2.361 . . . . 0.0 104.625 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 56.61 165.91 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.644 0 C-N-CA 125.893 1.677 . . . . 0.0 114.472 -171.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -64.81 149.03 90.24 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 N-CA-C 108.771 -1.28 . . . . 0.0 108.771 153.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.56 165.16 51.73 Favored Pre-proline 0 C--O 1.24 0.604 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 177.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -68.87 -165.57 0.14 Allowed 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.719 2.946 . . . . 0.0 111.007 173.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 55.58 71.94 0.52 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.931 1.292 . . . . 0.0 112.663 162.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -125.13 144.04 46.09 Favored Pre-proline 0 N--CA 1.474 0.772 0 O-C-N 121.405 -0.809 . . . . 0.0 112.621 -171.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.06 -23.17 18.6 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 123.711 2.941 . . . . 0.0 111.977 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.45 -25.72 2.8 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.198 1.399 . . . . 0.0 113.729 171.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.72 -2.38 57.01 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.065 -1.022 . . . . 0.0 113.311 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.4 m -56.03 -59.04 5.48 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-N 119.168 0.895 . . . . 0.0 110.44 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.418 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -59.16 -14.96 12.09 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 114.889 1.44 . . . . 0.0 114.889 -177.494 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mp -82.3 -5.62 58.69 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 118.714 0.688 . . . . 0.0 109.573 178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.7 mt -68.96 -11.85 61.09 Favored 'General case' 0 CA--C 1.532 0.281 0 O-C-N 120.844 -1.16 . . . . 0.0 112.418 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -70.07 -8.12 46.84 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -167.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -138.18 62.72 1.56 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 126.486 1.914 . . . . 0.0 106.61 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 72.2 p -141.34 -176.13 4.6 Favored 'General case' 0 C--O 1.235 0.307 0 O-C-N 120.611 -1.306 . . . . 0.0 110.97 -177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 8.1 m -144.81 -60.08 0.36 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.901 176.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 7.1 m95 68.68 159.54 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 125.128 1.371 . . . . 0.0 112.217 -176.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 13.9 t -136.61 129.38 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.335 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.541 HD11 HD12 ' A' ' 138' ' ' LEU . 52.1 tp -67.75 151.18 47.65 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 177.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.6 t -144.46 -23.36 0.53 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 115.356 1.613 . . . . 0.0 115.356 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.06 146.13 29.9 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 121.202 1.819 . . . . 0.0 110.188 175.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.696 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.8 t90 -135.66 110.84 8.96 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.8 139.19 34.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -64.68 -170.17 0.05 OUTLIER 'General case' 0 C--O 1.237 0.436 0 CA-C-N 118.729 0.695 . . . . 0.0 110.559 167.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.71 -28.91 65.09 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.276 -1.515 . . . . 0.0 113.521 174.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -81.81 -45.47 15.53 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 123.242 1.496 . . . . 0.0 111.216 -165.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 140.81 -5.1 2.5 Favored Glycine 0 CA--C 1.532 1.105 0 C-N-CA 128.107 2.765 . . . . 0.0 112.709 -166.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.8 m -62.32 99.91 0.16 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.818 1.309 . . . . 0.0 109.689 167.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -57.73 122.29 12.47 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 159.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -75.7 156.05 35.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 164.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.82 146.56 53.57 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 162.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 15.6 m -141.31 156.29 67.45 Favored Pre-proline 0 CA--C 1.54 0.56 0 N-CA-C 106.786 -1.561 . . . . 0.0 106.786 161.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -75.29 108.59 2.74 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.608 1.539 . . . . 0.0 109.307 176.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -61.08 159.44 11.74 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.52 -1.363 . . . . 0.0 108.739 163.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.72 88.22 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 122.776 0.43 . . . . 0.0 111.552 -173.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -19.78 66.05 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 112.695 0.628 . . . . 0.0 112.695 -178.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -65.86 -16.31 63.71 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.231 0.612 . . . . 0.0 112.638 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 143.29 -45.77 0.88 Allowed Glycine 0 C--N 1.337 0.628 0 C-N-CA 125.518 1.533 . . . . 0.0 111.174 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.445 ' HB1' ' HE2' ' A' ' 68' ' ' PHE . . . -157.39 86.7 2.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.565 -155.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -70.07 161.27 46.6 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.814 2.343 . . . . 0.0 111.634 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 23.3 mt -80.36 108.48 13.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 125.539 1.536 . . . . 0.0 109.05 166.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 70.2 p -91.85 169.79 10.4 Favored 'General case' 0 C--O 1.242 0.683 0 CA-C-O 122.178 0.989 . . . . 0.0 110.649 172.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -130.58 167.33 18.89 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 161.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 10.7 m -145.64 133.6 21.36 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 105.362 -2.088 . . . . 0.0 105.362 170.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.4 mt -133.0 82.15 1.98 Allowed 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 107.426 -1.324 . . . . 0.0 107.426 177.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 t -150.23 -154.97 0.59 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.942 1.297 . . . . 0.0 107.755 175.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 49.3 p -128.78 43.37 3.16 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.293 1.437 . . . . 0.0 111.993 -172.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 39.8 t -57.16 -41.84 79.96 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.466 -1.396 . . . . 0.0 112.461 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.1 p -76.75 -31.62 57.21 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 120.415 -1.428 . . . . 0.0 110.259 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 124.19 -23.86 6.39 Favored Glycine 0 CA--C 1.524 0.654 0 C-N-CA 127.986 2.708 . . . . 0.0 111.243 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -82.44 165.33 20.32 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.693 1.246 . . . . 0.0 109.079 170.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -74.37 80.13 1.88 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 166.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -117.33 155.89 28.77 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 120.365 -1.46 . . . . 0.0 111.07 171.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.66 144.33 28.64 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 169.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 3.0 p -150.63 65.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 122.514 1.149 . . . . 0.0 110.23 -173.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -103.57 -175.98 26.04 Favored Glycine 0 CA--C 1.522 0.496 0 C-N-CA 124.272 0.939 . . . . 0.0 111.394 -172.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 35.9 t80 -109.35 119.42 39.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 168.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.05 168.78 10.4 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 171.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.89 -42.73 8.0 Favored Glycine 0 CA--C 1.526 0.733 0 N-CA-C 115.955 1.142 . . . . 0.0 115.955 -144.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 49.4 t -129.38 -5.96 4.79 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.596 1.198 . . . . 0.0 112.67 166.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -131.6 123.19 27.37 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 105.857 -1.905 . . . . 0.0 105.857 -173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.3 mtt-85 -56.98 169.77 0.49 Allowed 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 123.088 0.555 . . . . 0.0 111.863 177.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -142.19 156.21 45.32 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.13 0.49 . . . . 0.0 110.832 175.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -154.15 155.54 35.52 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.763 1.225 . . . . 0.0 109.206 175.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 179.75 -98.32 0.11 Allowed Glycine 0 C--O 1.228 -0.273 0 N-CA-C 110.844 -0.902 . . . . 0.0 110.844 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 7.9 m -162.75 154.28 17.87 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.097 1.759 . . . . 0.0 108.017 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.412 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 7.4 p90 -139.11 167.55 21.81 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 119.462 1.028 . . . . 0.0 111.519 169.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.76 143.05 26.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 124.651 1.18 . . . . 0.0 108.298 176.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -96.64 116.35 28.97 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 166.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -150.99 162.06 41.55 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.811 1.245 . . . . 0.0 107.843 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 56.14 26.32 10.08 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.352 1.461 . . . . 0.0 113.612 166.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.83 21.08 65.0 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-O 118.463 -1.187 . . . . 0.0 112.814 -175.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.551 ' HA ' HG21 ' A' ' 118' ' ' THR . 16.7 pttp -135.93 166.78 22.54 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 119.389 1.594 . . . . 0.0 112.18 -178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.28 145.12 44.24 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 164.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.9 m -141.6 161.85 36.91 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 121.175 -0.953 . . . . 0.0 108.762 167.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 90.6 m-85 -130.67 164.04 25.89 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 123.353 0.661 . . . . 0.0 111.107 -174.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -99.05 -151.68 26.89 Favored Glycine 0 CA--C 1.522 0.504 0 C-N-CA 125.171 1.367 . . . . 0.0 110.051 173.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 t -66.66 121.23 14.93 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 171.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -111.26 166.84 10.75 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.569 1.948 . . . . 0.0 110.852 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 163.86 -167.48 37.96 Favored Glycine 0 CA--C 1.523 0.574 0 O-C-N 121.774 -0.579 . . . . 0.0 111.784 176.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -178.86 -156.79 18.05 Favored Glycine 0 CA--C 1.535 1.314 0 C-N-CA 126.164 1.84 . . . . 0.0 109.209 -176.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 1.7 t -90.8 170.37 10.16 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 118.667 1.233 . . . . 0.0 108.768 160.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.2 mtm180 -118.06 85.56 2.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 105.175 -2.157 . . . . 0.0 105.175 164.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.1 mtm -82.2 154.45 25.44 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 174.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -86.41 122.79 30.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.282 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 57.4 m -123.86 -32.57 3.27 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 123.809 0.844 . . . . 0.0 111.761 -170.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 16.9 ptp 45.88 56.05 6.37 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.909 1.684 . . . . 0.0 111.854 -175.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.7 p -144.07 159.59 52.31 Favored Pre-proline 0 C--O 1.238 0.471 0 C-N-CA 124.079 0.952 . . . . 0.0 110.847 -179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.29 -29.57 13.91 Favored 'Trans proline' 0 N--CA 1.455 -0.763 0 C-N-CA 122.765 2.31 . . . . 0.0 111.657 174.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.14 -7.08 84.23 Favored Glycine 0 CA--C 1.534 1.244 0 O-C-N 121.316 -0.865 . . . . 0.0 111.102 167.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -91.95 -42.67 4.64 Favored Glycine 0 CA--C 1.525 0.662 0 CA-C-N 120.202 2.001 . . . . 0.0 111.549 173.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -72.66 -19.19 61.47 Favored 'General case' 0 C--O 1.232 0.157 0 O-C-N 121.518 -0.989 . . . . 0.0 112.89 -172.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.6 tt -65.35 -15.86 19.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 124.516 1.126 . . . . 0.0 113.333 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.9 -50.12 19.26 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.736 1.214 . . . . 0.0 111.076 177.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.28 -19.56 71.61 Favored Glycine 0 CA--C 1.525 0.702 0 O-C-N 121.634 -0.666 . . . . 0.0 113.228 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.3 -50.89 23.54 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 118.721 1.261 . . . . 0.0 108.307 169.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -63.09 -48.49 78.36 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 123.4 0.68 . . . . 0.0 110.252 -172.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 30.3 mt -60.37 -27.74 67.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.514 -0.755 . . . . 0.0 112.031 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -68.2 -55.59 11.72 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.57 0.623 . . . . 0.0 109.61 171.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.89 69.45 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.671 1.189 . . . . 0.0 112.46 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 42.6 mt -65.58 -3.37 4.48 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.854 0.862 . . . . 0.0 113.215 175.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 65.9 p -102.42 11.65 37.69 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.519 1.054 . . . . 0.0 111.822 169.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 24.6 m-70 -135.69 43.77 2.56 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.793 1.637 . . . . 0.0 110.656 -176.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 115' ' ' ILE . 4.1 mp -79.97 91.33 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 O-C-N 119.478 -2.014 . . . . 0.0 105.72 159.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -85.84 -27.83 24.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 168.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.524 ' HG3' ' HB ' ' A' ' 131' ' ' VAL . 0.1 OUTLIER -147.19 165.84 28.8 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 128.389 2.676 . . . . 0.0 114.016 -172.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.551 HG21 ' HA ' ' A' ' 84' ' ' LYS . 12.1 t -161.0 163.62 31.57 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 124.994 1.318 . . . . 0.0 108.792 -178.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -138.62 92.24 0.2 Allowed Glycine 0 N--CA 1.445 -0.714 0 N-CA-C 108.394 -1.883 . . . . 0.0 108.394 172.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 93.0 t -80.73 125.22 39.26 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 CA-C-N 119.412 1.606 . . . . 0.0 108.774 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -109.74 85.7 2.15 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 125.656 1.582 . . . . 0.0 107.933 -174.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -11.88 59.92 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 124.927 1.291 . . . . 0.0 113.74 -175.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.85 138.4 42.87 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 124.904 1.281 . . . . 0.0 109.01 160.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -68.44 150.87 97.55 Favored Pre-proline 0 N--CA 1.445 -0.692 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 164.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.28 119.73 4.5 Favored 'Cis proline' 0 N--CA 1.456 -0.721 0 N-CA-C 109.087 -1.159 . . . . 0.0 109.087 -12.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -62.59 132.01 50.94 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.566 0.747 . . . . 0.0 110.857 -167.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -143.1 170.9 14.85 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.182 1.393 . . . . 0.0 109.8 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 42.5 ttp -139.88 118.28 12.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.071 1.348 . . . . 0.0 107.468 178.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -79.18 150.71 31.61 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 158.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 96.3 mt -116.78 147.78 41.77 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 153.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.524 ' HB ' ' HG3' ' A' ' 117' ' ' ARG . 58.4 t -124.76 131.07 73.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 106.765 -1.569 . . . . 0.0 106.765 171.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 10.9 mp -78.68 160.53 27.45 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 174.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -48.67 -36.63 16.46 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 113.877 -1.511 . . . . 0.0 112.38 171.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -80.49 -14.43 58.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.799 0.84 . . . . 0.0 110.27 -173.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 109.64 0.77 30.73 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.352 0.977 . . . . 0.0 114.183 -174.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -63.46 153.39 35.56 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.99 1.395 . . . . 0.0 109.563 -177.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.5 m -132.25 104.5 6.79 Favored 'General case' 0 C--O 1.238 0.47 0 O-C-N 121.754 -0.591 . . . . 0.0 109.925 -167.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.696 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.4 mm? -104.91 150.98 24.42 Favored 'General case' 0 CA--C 1.516 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 30' ' ' LEU . 46.5 m -141.76 123.96 15.55 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.058 0.943 . . . . 0.0 109.716 -167.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 5.2 m-85 -122.41 139.49 53.78 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.69 1.596 . . . . 0.0 109.438 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.22 147.34 29.01 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.447 1.499 . . . . 0.0 108.536 168.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.78 101.24 6.62 Favored 'General case' 0 C--O 1.234 0.239 0 O-C-N 120.671 -1.268 . . . . 0.0 109.457 168.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.3 t -84.48 118.36 24.25 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 148.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 97.0 m -138.53 65.19 1.47 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.353 1.861 . . . . 0.0 106.462 152.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 38.0 mtt85 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 126.853 2.061 . . . . 0.0 107.285 168.074 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 117.711 -1.138 . . . . 0.0 108.084 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.17 148.0 74.01 Favored 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.445 2.097 . . . . 0.0 110.999 -173.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 58.3 mttm -130.0 57.97 1.67 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.437 1.895 . . . . 0.0 108.145 -172.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 65.37 163.07 0.12 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 126.501 1.921 . . . . 0.0 112.24 -176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -70.32 -6.76 19.62 Favored 'Trans proline' 0 CA--C 1.536 0.608 0 C-N-CA 121.78 1.653 . . . . 0.0 113.469 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 71.3 175.71 0.29 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 128.675 2.79 . . . . 0.0 111.108 -177.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.1 m -126.87 -178.96 4.59 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 127.832 2.453 . . . . 0.0 109.236 -168.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 44.45 56.15 5.21 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 127.457 2.303 . . . . 0.0 115.401 166.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -142.49 108.21 5.12 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 124.315 1.046 . . . . 0.0 108.293 174.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 17.4 m -115.38 104.38 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 C-N-CA 125.487 1.515 . . . . 0.0 109.201 171.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -146.85 160.84 39.55 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 124.763 1.225 . . . . 0.0 110.042 167.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -72.93 164.35 35.81 Favored 'Trans proline' 0 CA--C 1.537 0.666 0 C-N-CA 122.935 2.424 . . . . 0.0 110.865 170.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -136.48 148.1 62.57 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.077 1.351 . . . . 0.0 107.71 -179.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -65.95 -169.79 0.17 Allowed 'Trans proline' 0 CA--C 1.536 0.615 0 C-N-CA 124.886 3.724 . . . . 0.0 113.432 167.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 73.58 163.33 0.27 Allowed 'General case' 0 C--O 1.233 0.223 0 C-N-CA 128.896 2.878 . . . . 0.0 111.004 177.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.4 p-10 -150.17 144.5 17.61 Favored Pre-proline 0 N--CA 1.435 -1.177 0 O-C-N 120.35 -1.469 . . . . 0.0 111.382 177.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.04 -41.0 10.56 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.825 2.35 . . . . 0.0 110.73 176.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.03 22.21 0.11 Allowed 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.911 1.284 . . . . 0.0 112.289 175.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.55 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -103.08 -27.35 12.63 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 119.626 1.103 . . . . 0.0 111.832 160.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 2.0 m -70.91 -21.75 62.33 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 125.018 1.327 . . . . 0.0 112.998 -171.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -52.4 -22.15 4.37 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.443 1.897 . . . . 0.0 113.445 165.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.4 mt -107.19 50.65 0.76 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.561 -171.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 91.3 mt -121.66 21.65 10.77 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.238 1.415 . . . . 0.0 110.27 176.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.39 -11.12 41.47 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.237 -0.915 . . . . 0.0 112.356 -179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -128.79 -6.63 5.07 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -83.06 -177.78 6.88 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.608 1.163 . . . . 0.0 112.833 -166.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.6 m -136.83 -64.87 0.57 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.428 -0.796 . . . . 0.0 112.056 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.3 m95 66.28 162.5 0.16 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 126.012 1.725 . . . . 0.0 113.581 -178.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 94.4 t -139.82 146.93 24.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 175.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -97.06 133.45 41.71 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -137.65 -3.76 1.85 Allowed 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.61 149.81 27.03 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-N 119.925 1.239 . . . . 0.0 112.171 166.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.754 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.6 t90 -137.55 132.67 33.51 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.328 2.651 . . . . 0.0 108.154 176.248 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.33 147.15 46.06 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 126.124 1.769 . . . . 0.0 109.405 174.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -90.85 178.13 6.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.901 0.319 . . . . 0.0 110.301 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.14 -30.52 69.35 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.966 0.506 . . . . 0.0 112.318 -177.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -100.2 18.95 17.42 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.052 0.454 . . . . 0.0 110.793 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 85.6 8.83 79.74 Favored Glycine 0 CA--C 1.526 0.747 0 O-C-N 120.018 -1.676 . . . . 0.0 112.268 170.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.4 m -66.41 100.98 0.69 Allowed 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 125.728 1.611 . . . . 0.0 108.181 176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.4 106.11 1.64 Allowed 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.457 1.026 . . . . 0.0 109.882 168.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -64.7 156.06 31.54 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.572 0.749 . . . . 0.0 110.183 175.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 142.46 54.66 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 167.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.5 m -144.23 159.52 52.06 Favored Pre-proline 0 CA--C 1.547 0.841 0 C-N-CA 125.656 1.583 . . . . 0.0 108.039 168.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -75.21 115.1 4.16 Favored 'Trans proline' 0 CA--C 1.536 0.581 0 C-N-CA 122.998 2.465 . . . . 0.0 110.435 171.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 166.83 12.59 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.49 1.916 . . . . 0.0 109.34 166.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.25 -52.42 65.67 Favored 'General case' 0 C--O 1.23 0.07 0 O-C-N 121.87 -0.519 . . . . 0.0 111.44 174.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.49 -8.4 26.17 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 113.021 0.749 . . . . 0.0 113.021 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -83.33 -15.41 50.14 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 120.892 -1.13 . . . . 0.0 112.201 175.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.66 -81.27 0.27 Allowed Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 111.437 -0.665 . . . . 0.0 111.437 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -112.45 85.48 7.21 Favored Pre-proline 0 N--CA 1.449 -0.483 0 C-N-CA 125.497 1.519 . . . . 0.0 107.998 -174.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -67.73 164.07 32.77 Favored 'Trans proline' 0 N--CA 1.455 -0.789 0 C-N-CA 122.829 2.353 . . . . 0.0 110.443 177.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.427 HG12 ' H ' ' A' ' 70' ' ' GLY . 41.0 mt -79.85 107.03 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 177.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.3 p -113.43 129.95 56.42 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 178.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.3 tp -95.43 155.34 16.78 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.783 1.633 . . . . 0.0 106.598 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.6 m -144.76 118.52 9.25 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.8 mt -117.12 85.59 2.35 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 -174.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.38 172.45 12.93 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 123.799 0.84 . . . . 0.0 110.231 -172.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 74.0 p -103.1 24.58 10.61 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.664 1.586 . . . . 0.0 112.873 -178.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.94 -47.09 52.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.701 1.591 . . . . 0.0 112.616 -177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -74.6 3.03 8.43 Favored 'General case' 0 CA--C 1.547 0.865 0 CA-C-N 118.995 0.816 . . . . 0.0 112.995 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 101.92 -27.36 20.78 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 127.388 2.423 . . . . 0.0 111.829 -171.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -120.27 152.7 37.4 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 118.316 1.058 . . . . 0.0 111.16 -172.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.1 ptp85 -65.6 96.88 0.28 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 169.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -131.59 154.27 49.04 Favored 'General case' 0 N--CA 1.433 -1.316 0 C-N-CA 124.242 1.017 . . . . 0.0 109.204 170.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -94.55 111.75 23.51 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 105.947 -1.871 . . . . 0.0 105.947 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.1 p -124.58 86.61 2.59 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 125.139 1.376 . . . . 0.0 108.354 -169.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -139.0 168.13 24.91 Favored Glycine 0 N--CA 1.469 0.873 0 O-C-N 120.994 -1.066 . . . . 0.0 111.514 -163.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.401 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 22.8 t80 -95.31 102.43 14.24 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 123.846 0.858 . . . . 0.0 109.752 -177.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.5 p -93.28 99.27 11.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 119.161 0.891 . . . . 0.0 109.001 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.427 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 75.07 -70.36 1.82 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 124.497 1.046 . . . . 0.0 112.784 166.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 28.3 t -130.94 -14.27 3.51 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.858 1.263 . . . . 0.0 112.797 175.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -133.87 133.79 41.96 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 106.686 -1.598 . . . . 0.0 106.686 -165.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.401 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 5.8 mtt180 -71.18 138.26 49.41 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 118.29 -1.364 . . . . 0.0 109.273 170.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -103.17 162.89 12.6 Favored 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 125.969 2.043 . . . . 0.0 109.409 168.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.96 161.61 41.97 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 126.752 2.021 . . . . 0.0 107.232 167.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -171.92 -108.92 0.22 Allowed Glycine 0 C--N 1.334 0.456 0 O-C-N 121.927 -0.483 . . . . 0.0 112.373 169.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 29.0 m -154.37 168.71 25.72 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 127.278 2.231 . . . . 0.0 106.795 166.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -142.48 171.56 13.89 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.088 0.555 . . . . 0.0 110.184 162.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -146.58 152.17 38.5 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.34 1.856 . . . . 0.0 107.868 170.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -99.8 128.39 45.9 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 172.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.6 ptpt -164.23 164.36 22.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 125.732 1.613 . . . . 0.0 108.639 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 t70 64.88 4.88 2.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.33 6.08 89.43 Favored Glycine 0 CA--C 1.532 1.099 0 CA-C-O 118.576 -1.124 . . . . 0.0 112.316 -166.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.4 pttp -123.24 168.27 12.66 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 126.34 1.856 . . . . 0.0 110.846 -173.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.64 135.45 35.04 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 105.818 -1.919 . . . . 0.0 105.818 169.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.29 131.48 55.76 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 165.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.413 ' CB ' HD11 ' A' ' 90' ' ' LEU . 98.3 m-85 -97.97 161.32 13.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 171.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -105.09 -147.9 16.83 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 174.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -57.59 99.99 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.532 0.733 . . . . 0.0 109.049 167.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.553 HD13 HD23 ' A' ' 112' ' ' LEU . 61.2 mt -98.24 142.8 29.45 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 125.069 1.348 . . . . 0.0 108.599 170.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.15 -177.01 48.32 Favored Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 109.874 -1.29 . . . . 0.0 109.874 169.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -170.08 -168.55 32.11 Favored Glycine 0 N--CA 1.441 -1.022 0 N-CA-C 109.519 -1.433 . . . . 0.0 109.519 -172.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 16.9 p -75.61 173.32 11.2 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.988 2.515 . . . . 0.0 112.468 178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -122.02 84.2 2.22 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 126.12 1.768 . . . . 0.0 108.899 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 11.0 mtt -73.68 -174.48 1.77 Allowed 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.21 1.404 . . . . 0.0 108.155 159.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -142.63 109.77 5.59 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 120.824 1.647 . . . . 0.0 111.658 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.268 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 68.2 m -93.98 -14.79 25.52 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 117.764 -1.112 . . . . 0.0 112.442 -177.036 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp 47.34 28.12 1.01 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.973 1.709 . . . . 0.0 114.824 -179.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -117.57 164.33 19.94 Favored Pre-proline 0 C--O 1.239 0.513 0 C-N-CA 126.432 1.893 . . . . 0.0 109.936 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 70.2 Cg_endo -72.92 -14.85 26.5 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.244 1.963 . . . . 0.0 113.788 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -90.31 -2.26 74.01 Favored Glycine 0 C--O 1.222 -0.604 0 CA-C-O 117.675 -1.625 . . . . 0.0 112.604 170.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.75 -58.62 1.59 Allowed Glycine 0 C--N 1.337 0.587 0 CA-C-N 119.958 1.879 . . . . 0.0 112.803 -175.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.07 -3.59 20.6 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -173.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -65.15 -10.48 9.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 124.135 0.974 . . . . 0.0 112.317 171.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -44.61 -60.68 1.87 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.265 1.426 . . . . 0.0 110.68 177.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -64.85 -30.11 77.1 Favored Glycine 0 CA--C 1.523 0.551 0 CA-C-O 118.501 -1.166 . . . . 0.0 112.333 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.45 -43.91 76.04 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 119.306 1.553 . . . . 0.0 109.845 178.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 76.4 t80 -63.72 -49.01 74.74 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.999 0.92 . . . . 0.0 109.758 -176.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.3 mt -59.39 -36.03 75.05 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.559 -0.734 . . . . 0.0 110.465 174.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -53.86 -51.95 61.99 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.191 0.996 . . . . 0.0 110.123 177.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -69.79 -30.46 68.0 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.534 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.553 HD23 HD13 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -62.45 -22.11 65.95 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.379 1.472 . . . . 0.0 112.527 177.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 30.0 p -73.08 -27.51 61.76 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.544 -0.722 . . . . 0.0 111.157 173.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -114.96 49.57 1.04 Allowed 'General case' 0 N--CA 1.457 -0.125 0 C-N-CA 126.26 1.824 . . . . 0.0 110.05 -165.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.408 HD12 HD23 ' A' ' 130' ' ' LEU . 8.5 mm -75.41 69.15 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 166.339 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -75.64 -32.7 60.32 Favored 'General case' 0 C--N 1.328 -0.359 0 O-C-N 120.818 -1.176 . . . . 0.0 109.286 177.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -133.67 160.18 38.31 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.554 1.542 . . . . 0.0 110.366 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.5 t -155.47 166.5 33.35 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.131 -0.981 . . . . 0.0 109.886 -162.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.55 76.1 0.09 OUTLIER Glycine 0 CA--C 1.531 1.069 0 CA-C-N 118.61 0.641 . . . . 0.0 113.131 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.55 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.255 5.2 p -86.17 127.17 40.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 O-C-N 120.173 -1.781 . . . . 0.0 110.314 171.583 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -99.58 80.71 2.4 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 125.367 1.467 . . . . 0.0 107.041 173.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.427 ' HG3' HE21 ' A' ' 126' ' ' GLN . 27.8 ttm -82.18 63.38 6.36 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.843 1.656 . . . . 0.0 110.966 177.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -139.32 130.01 25.98 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 165.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.45 137.16 16.69 Favored Pre-proline 0 N--CA 1.447 -0.618 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 168.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -72.61 122.06 7.12 Favored 'Cis proline' 0 CA--C 1.542 0.876 0 CA-C-N 119.419 0.828 . . . . 0.0 111.383 -6.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . 0.427 HE21 ' HG3' ' A' ' 122' ' ' MET . 58.6 mt-30 -75.7 135.77 40.38 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.376 1.07 . . . . 0.0 110.93 -169.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -146.19 176.19 9.93 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 125.972 1.709 . . . . 0.0 108.839 165.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -141.7 134.09 28.08 Favored 'General case' 0 N--CA 1.445 -0.705 0 C-N-CA 126.076 1.75 . . . . 0.0 108.027 174.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -112.22 155.25 24.32 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 126.611 1.964 . . . . 0.0 109.329 172.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.713 ' N ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -138.78 155.39 48.22 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 127.127 2.171 . . . . 0.0 109.904 162.526 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.5 t -134.06 136.59 53.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 177.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.0 mp -88.2 174.26 8.32 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 122.154 0.978 . . . . 0.0 111.287 -174.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -54.41 -39.71 67.55 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.619 1.968 . . . . 0.0 111.882 163.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -84.23 -20.81 31.64 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 126.491 1.916 . . . . 0.0 110.649 178.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 95.87 20.82 25.17 Favored Glycine 0 CA--C 1.528 0.888 0 CA-C-O 118.837 -0.98 . . . . 0.0 114.369 175.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -53.82 155.91 3.06 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.032 1.416 . . . . 0.0 108.729 163.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.06 110.55 11.71 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 126.037 1.735 . . . . 0.0 106.676 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.754 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -116.61 150.38 38.17 Favored 'General case' 0 CA--C 1.515 -0.366 0 O-C-N 121.451 -0.781 . . . . 0.0 109.239 -172.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 38.7 m -138.4 103.79 4.99 Favored 'General case' 0 C--O 1.239 0.541 0 O-C-N 124.277 0.986 . . . . 0.0 111.419 -162.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.469 ' HE1' HD11 ' A' ' 130' ' ' LEU . 96.2 m-85 -92.59 168.8 10.99 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.707 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -119.39 143.58 47.37 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 126.573 1.949 . . . . 0.0 107.698 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -75.76 104.02 6.12 Favored 'General case' 0 N--CA 1.464 0.245 0 O-C-N 120.539 -1.351 . . . . 0.0 108.978 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 2.6 t -99.3 115.84 30.09 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 105.855 -1.905 . . . . 0.0 105.855 150.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 p -128.06 1.1 5.89 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.87 1.268 . . . . 0.0 112.629 156.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 . . . . . 0 C--O 1.258 1.547 0 C-N-CA 131.239 3.815 . . . . 0.0 104.164 -167.54 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 13.0 pt . . . . . 0 N--CA 1.473 0.719 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -67.12 -177.27 0.99 Allowed 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 121.719 1.613 . . . . 0.0 109.942 166.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.96 172.57 12.57 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 163.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 17.7 p80 -138.64 160.52 63.03 Favored Pre-proline 0 C--N 1.327 -0.378 0 C-N-CA 126.179 1.791 . . . . 0.0 107.661 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -76.23 95.14 1.02 Allowed 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.003 2.469 . . . . 0.0 108.574 168.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -133.61 169.46 16.96 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 159.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.3 m -111.62 159.28 18.32 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.278 1.431 . . . . 0.0 109.667 178.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.9 14.39 30.87 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.968 0.889 . . . . 0.0 112.553 -176.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.88 34.52 0.67 Allowed 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.476 1.11 . . . . 0.0 112.168 -168.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.05 152.46 12.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 C-N-CA 126.954 2.101 . . . . 0.0 108.193 -172.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -140.81 157.02 68.54 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 126.869 2.067 . . . . 0.0 108.045 -178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo -73.95 173.48 13.96 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.434 2.756 . . . . 0.0 110.991 -176.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.34 159.96 45.43 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 124.453 1.101 . . . . 0.0 110.644 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -76.3 176.12 10.47 Favored 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 123.543 2.828 . . . . 0.0 111.947 -175.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 55.02 54.32 9.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.76 1.224 . . . . 0.0 111.055 174.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.39 156.98 45.37 Favored Pre-proline 0 N--CA 1.466 0.35 0 C-N-CA 123.698 0.799 . . . . 0.0 111.627 -176.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.89 -38.0 31.77 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.898 3.065 . . . . 0.0 112.883 176.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.8 19.61 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 127.449 2.3 . . . . 0.0 115.468 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -138.84 -8.64 1.39 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.46 1.504 . . . . 0.0 113.261 -170.27 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.537 HG23 HD12 ' A' ' 23' ' ' LEU . 5.5 m -79.53 -19.37 49.73 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.971 1.26 . . . . 0.0 112.801 175.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 -57.03 -19.23 17.57 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 120.124 1.329 . . . . 0.0 113.702 176.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -89.55 3.84 51.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.72 0.691 . . . . 0.0 110.388 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.537 HD12 HG23 ' A' ' 20' ' ' THR . 32.3 mt -84.99 66.19 9.63 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 119.492 1.042 . . . . 0.0 110.633 -175.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.8 p30 -120.48 -48.35 2.3 Favored 'General case' 0 CA--C 1.511 -0.531 0 C-N-CA 124.125 0.97 . . . . 0.0 112.502 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -127.95 57.8 1.53 Allowed 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 -178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 81.2 p -139.98 160.89 38.9 Favored 'General case' 0 C--N 1.337 0.055 0 CA-C-O 122.084 0.945 . . . . 0.0 110.63 -173.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.524 ' H ' ' NH1' ' A' ' 142' ' ' ARG . 3.2 p -142.49 136.43 29.38 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 124.123 0.969 . . . . 0.0 109.008 -158.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 47.8 m95 -149.97 165.22 33.31 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 123.855 0.722 . . . . 0.0 109.901 -165.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 70.4 t -142.01 123.53 12.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 176.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.52 130.84 45.21 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -134.55 -6.08 2.54 Favored 'General case' 0 CA--C 1.541 0.618 0 O-C-N 123.552 0.533 . . . . 0.0 111.918 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.9 162.13 36.87 Favored 'General case' 0 C--N 1.344 0.368 0 O-C-N 121.019 -1.051 . . . . 0.0 110.918 169.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -145.76 116.69 7.76 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 107.05 -1.463 . . . . 0.0 107.05 177.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.63 138.72 38.24 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 174.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -71.28 167.27 19.82 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 118.574 0.625 . . . . 0.0 109.344 167.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.4 -30.16 70.38 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 123.18 0.592 . . . . 0.0 112.393 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -74.86 -45.07 45.49 Favored 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.69 3.47 1.78 Allowed Glycine 0 CA--C 1.531 1.035 0 CA-C-O 119.118 -0.823 . . . . 0.0 113.792 -172.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.6 m -65.04 101.63 0.53 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.377 2.089 . . . . 0.0 108.379 172.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.86 108.41 0.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 O-C-N 121.028 -1.045 . . . . 0.0 109.398 165.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 23.4 mtt180 -66.65 161.83 22.47 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.098 0.959 . . . . 0.0 110.446 176.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.38 145.34 39.48 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 158.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.7 m -140.49 165.42 30.22 Favored Pre-proline 0 CA--C 1.544 0.738 0 C-N-CA 126.424 1.89 . . . . 0.0 107.561 168.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -70.97 127.44 13.64 Favored 'Trans proline' 0 N--CA 1.456 -0.723 0 CA-C-N 120.556 1.234 . . . . 0.0 110.884 173.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.77 162.44 16.04 Favored 'General case' 0 N--CA 1.444 -0.77 0 C-N-CA 124.819 1.248 . . . . 0.0 112.002 164.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.15 -36.63 61.06 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 121.497 -0.752 . . . . 0.0 110.443 164.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -73.9 -21.06 60.21 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.936 0.895 . . . . 0.0 112.957 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.3 mm-40 -70.36 -11.86 61.2 Favored 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.574 -0.704 . . . . 0.0 112.523 -175.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.1 -1.63 38.05 Favored Glycine 0 CA--C 1.525 0.712 0 CA-C-O 118.437 -1.202 . . . . 0.0 113.389 175.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.584 ' HB1' ' HE1' ' A' ' 68' ' ' PHE . . . -169.6 83.6 0.62 Allowed Pre-proline 0 CA--C 1.546 0.82 0 C-N-CA 124.844 1.258 . . . . 0.0 111.064 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.6 157.09 63.27 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 121.97 1.78 . . . . 0.0 110.357 171.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 32.2 mt -87.25 111.55 21.98 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 177.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 43.1 p -123.37 132.29 53.93 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -169.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 51.1 tp -111.58 134.5 53.11 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 124.993 1.317 . . . . 0.0 108.527 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 30.1 m -124.14 140.65 52.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 167.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 44.4 mt -123.3 121.56 36.15 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 105.82 -1.919 . . . . 0.0 105.82 174.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.9 t -172.67 -174.26 1.12 Allowed 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 72.2 p -113.5 36.05 3.76 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.067 1.347 . . . . 0.0 112.545 -171.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.8 m -49.12 -14.63 0.08 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 170.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 t -113.07 3.12 15.96 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.295 1.407 . . . . 0.0 111.096 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.02 -13.23 39.13 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 119.902 1.228 . . . . 0.0 111.692 -174.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.5 mp0 -113.67 166.07 11.91 Favored 'General case' 0 N--CA 1.448 -0.553 0 O-C-N 121.232 -1.157 . . . . 0.0 110.422 164.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -55.47 115.78 2.5 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 124.642 1.177 . . . . 0.0 110.046 165.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -144.96 168.86 19.25 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.273 1.029 . . . . 0.0 108.403 176.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -137.13 73.47 1.45 Allowed 'General case' 0 C--O 1.234 0.24 0 C-N-CA 124.443 1.097 . . . . 0.0 109.12 -176.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 t -68.98 116.42 9.42 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -145.73 175.84 25.03 Favored Glycine 0 C--N 1.328 0.087 0 N-CA-C 110.62 -0.992 . . . . 0.0 110.62 -167.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.584 ' HE1' ' HB1' ' A' ' 50' ' ' ALA . 29.6 t80 -129.56 106.87 9.04 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 -173.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 19.3 m -78.05 -177.14 4.89 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.126 0.971 . . . . 0.0 108.796 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -43.98 -30.5 1.75 Allowed Glycine 0 CA--C 1.535 1.338 0 C-N-CA 126.277 1.894 . . . . 0.0 117.324 -163.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.8 OUTLIER -147.58 6.88 0.84 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 119.403 1.601 . . . . 0.0 114.502 156.282 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.41 ' ND2' ' H ' ' A' ' 95' ' ' MET . 10.5 m120 -134.05 122.29 22.75 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 -160.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -69.12 146.78 52.24 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.232 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 46.7 p90 -130.58 166.15 21.23 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 126.238 1.815 . . . . 0.0 109.422 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.1 ptp -154.7 163.21 40.58 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 126.448 1.899 . . . . 0.0 108.066 178.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 154.41 172.04 21.9 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.72 -1.752 . . . . 0.0 108.72 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 46.1 p -94.6 153.74 17.7 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 125.156 1.382 . . . . 0.0 111.589 -170.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -108.99 166.29 10.94 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.497 0.665 . . . . 0.0 110.764 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.11 122.2 7.7 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.112 1.365 . . . . 0.0 107.862 177.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.1 mt -101.47 111.84 24.2 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.565 1.546 . . . . 0.0 107.876 -172.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -154.52 163.53 40.06 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 126.171 1.788 . . . . 0.0 108.807 -175.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t70 48.7 29.24 2.11 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 127.694 2.398 . . . . 0.0 116.953 163.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.16 11.73 71.1 Favored Glycine 0 CA--C 1.533 1.196 0 O-C-N 120.85 -1.156 . . . . 0.0 113.228 -174.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 29.6 pttt -129.6 165.65 21.32 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.737 2.415 . . . . 0.0 112.242 -170.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.89 92.07 3.63 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 -174.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 33.5 t -86.69 167.14 14.76 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -129.44 173.56 10.44 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.413 1.085 . . . . 0.0 110.702 173.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -106.34 -136.75 8.46 Favored Glycine 0 CA--C 1.528 0.864 0 C-N-CA 127.783 2.611 . . . . 0.0 108.942 170.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.9 m -64.42 83.65 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.771 1.629 . . . . 0.0 111.546 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 97.0 mt -77.02 143.33 39.43 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 120.848 -1.157 . . . . 0.0 108.929 169.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 173.83 -176.63 46.33 Favored Glycine 0 CA--C 1.52 0.393 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 168.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -168.68 -141.66 3.27 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.518 0.659 . . . . 0.0 112.347 -159.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.7 t -115.53 168.22 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 169.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -126.71 90.8 3.23 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 171.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . 0.41 ' H ' ' ND2' ' A' ' 72' ' ' ASN . 9.6 mtm -102.68 172.85 6.61 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 105.891 -1.892 . . . . 0.0 105.891 168.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -130.78 107.12 8.91 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 120.542 1.519 . . . . 0.0 111.796 -174.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.7 m -79.22 -7.18 58.05 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.183 0.993 . . . . 0.0 113.544 170.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER 66.51 20.79 10.85 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.235 1.814 . . . . 0.0 113.227 176.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 17.3 p -127.03 161.31 54.58 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.099 1.76 . . . . 0.0 110.978 -170.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.43 -37.4 5.68 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.37 2.047 . . . . 0.0 111.034 -179.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.49 -30.5 75.11 Favored Glycine 0 C--O 1.22 -0.753 0 CA-C-O 118.321 -1.266 . . . . 0.0 110.361 173.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -57.95 -60.8 8.3 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.116 1.458 . . . . 0.0 109.889 167.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 -81.82 1.86 32.82 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -164.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tt -78.99 -7.73 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 O-C-N 121.195 -0.941 . . . . 0.0 110.43 166.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -44.46 -59.28 2.5 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.689 1.596 . . . . 0.0 111.842 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.82 -35.84 87.93 Favored Glycine 0 C--N 1.334 0.423 0 CA-C-O 119.155 -0.803 . . . . 0.0 111.213 -175.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.69 -40.19 84.39 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 118.267 1.034 . . . . 0.0 109.985 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 48.1 t80 -64.38 -43.76 93.48 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 118.464 -0.779 . . . . 0.0 109.942 177.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.3 -38.02 76.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.885 1.221 . . . . 0.0 110.011 172.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -65.26 -19.21 65.86 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.211 1.005 . . . . 0.0 113.631 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -87.6 -25.16 23.72 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.687 0.795 . . . . 0.0 110.681 175.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 65.6 mt -80.78 11.62 3.77 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 124.908 1.283 . . . . 0.0 113.126 175.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -109.86 -5.99 15.36 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 125.667 1.587 . . . . 0.0 111.306 164.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -126.31 66.66 1.22 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.684 1.194 . . . . 0.0 108.415 -172.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 115' ' ' ILE . 3.1 mp -101.31 31.56 0.49 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.321 0 O-C-N 120.959 -1.088 . . . . 0.0 110.592 -179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -54.42 -29.06 48.0 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.232 -1.542 . . . . 0.0 113.435 -168.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 74.4 mtm180 -125.79 163.67 22.38 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.449 1.5 . . . . 0.0 110.02 170.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 93.6 m -157.97 165.81 34.18 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 125.355 1.462 . . . . 0.0 107.104 176.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -161.88 127.42 1.72 Allowed Glycine 0 N--CA 1.443 -0.89 0 N-CA-C 109.82 -1.312 . . . . 0.0 109.82 169.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 48.1 t -101.74 142.35 16.44 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-N 118.874 1.337 . . . . 0.0 108.097 171.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -97.86 75.58 2.39 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 105.124 -2.176 . . . . 0.0 105.124 172.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.9 ttm -77.25 73.52 3.83 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.8 1.24 . . . . 0.0 107.757 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -159.5 140.22 12.37 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 104.528 -2.397 . . . . 0.0 104.528 171.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -63.2 132.19 95.01 Favored Pre-proline 0 N--CA 1.446 -0.674 0 N-CA-C 108.031 -1.099 . . . . 0.0 108.031 173.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -78.49 120.63 7.36 Favored 'Cis proline' 0 N--CA 1.458 -0.564 0 CA-C-N 119.925 1.009 . . . . 0.0 111.647 -1.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -67.67 131.18 45.11 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.56 0.695 . . . . 0.0 110.981 -172.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -146.11 164.08 33.31 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 125.615 1.566 . . . . 0.0 106.948 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 9.1 tmm? -138.48 147.96 43.8 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 125.842 1.657 . . . . 0.0 107.26 -173.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -130.11 141.99 50.64 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 166.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.36 161.33 14.43 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.114 -1.81 . . . . 0.0 106.114 160.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 58.0 t -136.07 121.42 28.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 168.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.8 mp -70.06 170.4 11.48 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-O 121.236 0.541 . . . . 0.0 111.158 -178.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 46.1 p-10 -64.52 -26.11 68.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-O 118.222 -0.894 . . . . 0.0 112.481 169.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -74.58 -37.41 62.92 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 119.703 1.138 . . . . 0.0 108.848 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 116.53 10.92 9.94 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.373 -173.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -55.65 151.02 11.45 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 120.332 2.066 . . . . 0.0 108.628 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.6 m -130.41 96.67 4.2 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.802 0.841 . . . . 0.0 109.065 -175.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.9 mp -79.04 133.07 36.82 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 124.623 1.169 . . . . 0.0 107.867 169.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.9 m -108.65 128.62 55.01 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.438 1.095 . . . . 0.0 109.431 175.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -120.87 131.07 54.19 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.725 1.21 . . . . 0.0 109.311 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -84.43 148.12 26.75 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 124.823 1.249 . . . . 0.0 109.62 172.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.524 ' NH1' ' H ' ' A' ' 27' ' ' SER . 34.0 tpt85 -70.26 132.94 46.48 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 117.737 -1.125 . . . . 0.0 108.423 173.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -133.87 60.91 1.69 Allowed 'General case' 0 C--N 1.347 0.47 0 CA-C-N 120.338 1.426 . . . . 0.0 110.517 -178.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 3.77 7.92 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 21.1 ttm-85 . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.195 1.398 . . . . 0.0 112.97 -169.804 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.1 mm . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -65.74 175.48 4.42 Favored 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 122.469 2.112 . . . . 0.0 110.713 168.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' H ' ' CD2' ' A' ' 4' ' ' HIS . 54.7 mtmt -140.68 34.73 1.81 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.968 1.707 . . . . 0.0 108.844 173.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CD2' ' H ' ' A' ' 3' ' ' LYS . 0.1 OUTLIER -171.7 161.11 4.87 Favored Pre-proline 0 CA--C 1.536 0.414 0 C-N-CA 126.269 1.828 . . . . 0.0 109.882 -162.678 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -77.39 -7.97 17.13 Favored 'Trans proline' 0 CA--C 1.535 0.549 0 C-N-CA 123.777 2.985 . . . . 0.0 112.697 169.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.54 21.34 11.11 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.242 2.217 . . . . 0.0 113.095 176.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.3 p -153.93 179.97 8.41 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.061 1.345 . . . . 0.0 109.897 174.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -130.59 82.64 2.07 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.557 1.543 . . . . 0.0 107.496 -175.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.85 90.71 3.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.609 1.564 . . . . 0.0 107.009 170.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.6 t -129.5 100.45 5.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 177.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -122.67 163.7 31.17 Favored Pre-proline 0 CA--C 1.535 0.385 0 C-N-CA 126.627 1.971 . . . . 0.0 108.411 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -68.4 137.45 39.76 Favored 'Trans proline' 0 N--CA 1.452 -0.961 0 C-N-CA 122.025 1.817 . . . . 0.0 108.663 168.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -84.28 144.28 43.45 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -78.99 -166.78 0.43 Allowed 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 123.17 2.58 . . . . 0.0 114.173 -166.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 63.27 77.53 0.32 Allowed 'General case' 0 C--N 1.342 0.281 0 C-N-CA 128.287 2.635 . . . . 0.0 110.896 179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.82 144.45 89.94 Favored Pre-proline 0 N--CA 1.469 0.502 0 CA-C-O 118.953 -0.546 . . . . 0.0 109.917 -177.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -71.53 -14.74 30.73 Favored 'Trans proline' 0 CA--C 1.535 0.564 0 C-N-CA 123.38 2.72 . . . . 0.0 112.528 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.64 31.9 0.41 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 126.405 1.882 . . . . 0.0 112.169 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.483 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -131.64 -28.3 1.84 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 120.741 -1.225 . . . . 0.0 112.213 -174.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.5 m -67.26 -17.23 64.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.994 0.815 . . . . 0.0 110.978 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 24.2 pt20 -59.47 -11.26 4.22 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.961 1.304 . . . . 0.0 114.186 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 47.1 mt -106.6 7.72 30.85 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 125.526 1.53 . . . . 0.0 111.581 -172.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.37 51.8 0.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.121 1.368 . . . . 0.0 110.816 -172.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.45 0.95 0.81 Allowed 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 115.995 1.85 . . . . 0.0 115.995 -165.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -115.0 -7.95 12.51 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.684 0.793 . . . . 0.0 111.451 148.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 80.8 p -73.83 -176.7 2.53 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.956 0.884 . . . . 0.0 112.047 -155.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 18.7 m -149.52 -68.42 0.21 Allowed 'General case' 0 C--O 1.22 -0.472 0 O-C-N 119.114 -2.241 . . . . 0.0 110.61 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.6 m95 69.78 163.44 0.24 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.822 1.249 . . . . 0.0 112.841 177.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.4 t -143.51 119.55 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.183 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -63.58 136.69 57.72 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 106.916 -1.513 . . . . 0.0 106.916 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -134.38 -11.51 2.46 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 113.388 0.884 . . . . 0.0 113.388 177.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.95 151.37 28.44 Favored 'General case' 0 CA--C 1.515 -0.392 0 O-C-N 120.415 -1.428 . . . . 0.0 109.39 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.7 t90 -132.34 107.46 8.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.4 tppt? -91.72 140.7 29.46 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 169.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -68.84 163.84 23.33 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 123.589 0.756 . . . . 0.0 110.372 166.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.45 -33.52 69.82 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.708 0.803 . . . . 0.0 112.337 171.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -77.84 -21.22 51.8 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.502 0.592 . . . . 0.0 112.091 177.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 112.72 6.07 23.45 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 124.735 1.159 . . . . 0.0 114.669 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 3.4 m -68.28 115.41 7.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 126.877 2.071 . . . . 0.0 108.592 171.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.59 107.32 4.4 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 120.787 -1.196 . . . . 0.0 110.423 167.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 28.0 mtt180 -65.6 149.28 50.34 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.716 0.806 . . . . 0.0 110.18 173.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.97 139.59 58.78 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 123.104 0.562 . . . . 0.0 109.724 166.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -139.12 160.86 60.72 Favored Pre-proline 0 CA--C 1.551 0.987 0 C-N-CA 127.45 2.3 . . . . 0.0 108.574 172.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.78 116.06 4.5 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.532 2.155 . . . . 0.0 110.822 177.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.63 168.52 17.51 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 121.865 0.84 . . . . 0.0 111.597 176.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.26 -38.91 81.27 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.826 168.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -87.93 15.85 6.69 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.292 1.437 . . . . 0.0 111.597 176.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -105.76 -27.6 11.18 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.471 161.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 131.93 -27.33 3.67 Favored Glycine 0 CA--C 1.523 0.56 0 C-N-CA 123.545 0.593 . . . . 0.0 114.364 157.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -136.34 73.04 57.73 Favored Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 125.049 1.34 . . . . 0.0 110.101 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -65.11 143.54 78.56 Favored 'Trans proline' 0 N--CA 1.451 -0.988 0 C-N-CA 121.858 1.705 . . . . 0.0 108.118 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 83.9 mt -70.83 99.56 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 125.526 1.53 . . . . 0.0 109.27 -169.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 2.8 p -87.41 149.85 24.19 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 126.544 1.938 . . . . 0.0 107.778 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 21.3 tp -127.87 157.8 39.52 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.299 1.44 . . . . 0.0 107.906 173.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -144.62 108.32 4.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 177.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.42 108.85 19.88 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 106.88 -1.526 . . . . 0.0 106.88 169.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 t -149.68 174.69 12.3 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.04 35.22 4.82 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.079 0.952 . . . . 0.0 109.924 171.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.2 t -48.35 -52.54 21.19 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.112 0.965 . . . . 0.0 110.224 176.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 3.5 t -84.52 10.23 11.48 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.656 1.182 . . . . 0.0 111.778 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 83.85 -38.63 2.82 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 127.016 2.246 . . . . 0.0 111.476 -176.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 4.3 mp0 -73.43 150.29 41.81 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 173.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp85 -72.25 98.47 2.18 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 167.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -126.44 152.84 45.85 Favored 'General case' 0 N--CA 1.434 -1.248 0 CA-C-O 122.438 1.113 . . . . 0.0 110.375 176.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -74.93 133.37 41.78 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 153.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 53.5 p -116.24 172.0 7.46 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 141.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 170.93 175.1 39.27 Favored Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 109.203 -1.559 . . . . 0.0 109.203 179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -109.64 94.62 5.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 -176.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 12.6 m -73.56 80.21 1.47 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.697 0.761 . . . . 0.0 109.643 175.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 85.18 -51.57 4.55 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 124.388 0.994 . . . . 0.0 112.695 155.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -152.48 14.18 0.57 Allowed 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 121.924 -0.751 . . . . 0.0 111.873 153.56 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -139.7 110.32 6.71 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.775 -1.203 . . . . 0.0 108.304 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.64 136.06 40.45 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 125.957 1.703 . . . . 0.0 113.981 -177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -112.03 168.33 9.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 C-N-CA 126.243 1.817 . . . . 0.0 110.788 -177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -152.73 156.72 39.69 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 126.142 1.777 . . . . 0.0 107.338 166.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -170.37 -109.29 0.22 Allowed Glycine 0 CA--C 1.525 0.711 0 O-C-N 121.622 -0.674 . . . . 0.0 111.883 177.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.6 168.88 22.69 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.405 1.482 . . . . 0.0 107.917 174.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.3 p90 -152.12 169.39 22.52 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.639 1.176 . . . . 0.0 110.661 170.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.18 157.15 42.3 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.77 1.628 . . . . 0.0 109.451 174.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.26 138.81 47.25 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.253 1.021 . . . . 0.0 108.834 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.1 ptpt -162.31 164.69 27.36 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.922 2.089 . . . . 0.0 108.321 167.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.5 t0 51.67 32.83 9.83 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 114.695 1.368 . . . . 0.0 114.695 162.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 58.34 29.43 63.21 Favored Glycine 0 CA--C 1.527 0.825 0 O-C-N 121.197 -0.94 . . . . 0.0 113.332 -173.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -128.54 154.79 45.78 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 128.173 2.589 . . . . 0.0 110.93 -175.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.4 HD22 ' CE1' ' A' ' 87' ' ' PHE . 0.1 OUTLIER -114.48 99.52 7.62 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 104.329 -2.471 . . . . 0.0 104.329 178.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.5 m -100.85 153.22 19.67 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 106.886 -1.524 . . . . 0.0 106.886 -175.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.472 ' CE1' HD12 ' A' ' 112' ' ' LEU . 37.9 m-85 -115.52 161.68 18.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 122.008 0.909 . . . . 0.0 110.087 -171.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -80.51 -168.09 37.9 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 108.693 -1.763 . . . . 0.0 108.693 159.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.85 149.97 34.26 Favored 'General case' 0 N--CA 1.443 -0.815 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 165.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.8 mt -126.16 171.73 10.63 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 125.574 1.55 . . . . 0.0 110.568 -170.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 166.78 175.99 37.42 Favored Glycine 0 CA--C 1.523 0.594 0 C-N-CA 124.034 0.826 . . . . 0.0 111.081 164.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -159.43 -115.77 0.42 Allowed Glycine 0 CA--C 1.531 1.036 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.0 t -115.12 -175.1 2.62 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 129.793 3.237 . . . . 0.0 109.872 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.2 mmt180 -141.98 56.05 1.48 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.465 1.906 . . . . 0.0 108.337 178.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 8.4 mtm -67.97 159.01 31.53 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.265 -0.897 . . . . 0.0 109.753 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.9 112.18 23.84 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.989 1.316 . . . . 0.0 110.305 -172.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.281 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 7.1 m -117.49 -9.34 10.86 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 -176.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 55.7 mtm 61.03 22.37 12.63 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.148 0.979 . . . . 0.0 112.844 171.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 25.3 p -114.18 154.43 46.24 Favored Pre-proline 0 C--N 1.327 -0.388 0 C-N-CA 126.303 1.841 . . . . 0.0 108.988 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -64.57 -40.95 21.31 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 120.891 1.061 . . . . 0.0 109.522 170.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -70.54 -5.62 56.25 Favored Glycine 0 C--O 1.22 -0.742 0 CA-C-O 116.824 -2.098 . . . . 0.0 113.841 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . 0.401 ' HA2' ' HB2' ' A' ' 71' ' ' CYS . . . -78.25 -57.88 3.3 Favored Glycine 0 C--N 1.34 0.768 0 CA-C-N 120.933 2.367 . . . . 0.0 109.784 168.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -69.36 -15.88 63.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 124.05 0.94 . . . . 0.0 111.846 -167.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.53 -6.13 2.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 123.716 0.806 . . . . 0.0 111.68 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -44.26 -52.57 7.39 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.706 1.139 . . . . 0.0 110.44 165.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -60.77 -46.36 94.65 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 119.934 -0.37 . . . . 0.0 112.498 -173.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.18 -38.47 85.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.188 0.494 . . . . 0.0 109.81 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 34.1 t80 -68.64 -47.06 67.55 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.228 -0.92 . . . . 0.0 111.016 -173.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.01 -29.32 68.4 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-N 118.763 0.71 . . . . 0.0 111.017 173.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.86 -42.02 90.91 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 123.084 0.554 . . . . 0.0 111.293 171.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.35 65.22 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 123.651 0.78 . . . . 0.0 112.111 -173.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.472 HD12 ' CE1' ' A' ' 87' ' ' PHE . 1.1 mm? -71.83 -12.52 61.32 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.781 169.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 12.1 p -93.78 13.96 20.79 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 120.547 1.521 . . . . 0.0 112.311 -175.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -141.11 28.72 1.87 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 119.53 1.059 . . . . 0.0 111.804 -171.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.9 mm -71.56 80.57 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 125.441 1.497 . . . . 0.0 107.447 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -80.27 -34.67 36.84 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 121.241 -0.912 . . . . 0.0 109.494 165.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -125.4 164.04 21.29 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.101 0.96 . . . . 0.0 110.576 -176.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 53.7 m -160.87 145.28 13.82 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 106.145 -1.798 . . . . 0.0 106.145 174.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.04 91.78 0.15 Allowed Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 108.229 -1.949 . . . . 0.0 108.229 -177.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.483 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.266 4.5 p -87.59 132.46 32.78 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.389 1.094 . . . . 0.0 110.091 165.746 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -98.42 88.52 4.15 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 166.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 51.8 tpp -82.67 57.48 3.79 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 174.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -145.08 116.51 8.04 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 177.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -49.27 125.48 14.97 Favored Pre-proline 0 C--O 1.236 0.39 0 CA-C-O 117.297 -1.335 . . . . 0.0 109.517 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 115.2 3.41 Favored 'Cis proline' 0 CA--C 1.538 0.691 0 O-C-N 122.933 0.965 . . . . 0.0 112.706 5.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -78.82 129.71 34.89 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -167.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -144.67 160.29 41.44 Favored 'General case' 0 C--N 1.325 -0.484 0 C-N-CA 125.443 1.497 . . . . 0.0 108.424 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 46.6 ttp -134.09 127.11 31.48 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 -178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -123.61 109.72 14.11 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.813 0.845 . . . . 0.0 108.737 -174.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 16.3 mt -94.04 143.49 26.32 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 53.6 t -131.85 136.29 57.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.2 mp -95.33 171.27 8.81 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.625 0.726 . . . . 0.0 110.497 -174.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -53.31 -27.47 23.3 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.875 1.27 . . . . 0.0 112.621 168.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 27.2 p30 -90.66 -16.56 28.38 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 118.13 -0.938 . . . . 0.0 112.193 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 105.99 8.35 34.25 Favored Glycine 0 CA--C 1.533 1.162 0 CA-C-O 117.693 -1.615 . . . . 0.0 115.607 177.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -50.18 165.45 0.09 Allowed 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 120.063 1.931 . . . . 0.0 110.842 173.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.3 m -142.11 95.86 2.87 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 120.243 -1.536 . . . . 0.0 109.67 174.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.0 mp -86.92 146.72 26.06 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 121.156 -0.965 . . . . 0.0 108.68 173.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 91.4 m -125.46 125.23 43.0 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 124.94 1.296 . . . . 0.0 109.038 -176.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -123.07 135.01 54.23 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.322 1.049 . . . . 0.0 110.084 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -81.54 147.51 29.62 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.912 1.285 . . . . 0.0 108.338 169.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 8.8 tpt85 -76.26 100.42 5.08 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.694 -1.254 . . . . 0.0 108.94 165.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 20.7 t -75.76 127.65 33.48 Favored 'General case' 0 C--O 1.242 0.661 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 146.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.7 t -131.47 17.2 4.88 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.455 1.902 . . . . 0.0 112.853 173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 . . . . . 0 C--O 1.251 1.181 0 CA-C-N 118.872 0.76 . . . . 0.0 110.065 170.145 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 106.169 -1.789 . . . . 0.0 106.169 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -72.66 169.21 22.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.853 1.702 . . . . 0.0 109.552 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.74 106.77 17.24 Favored 'General case' 0 C--O 1.232 0.143 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 170.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 -101.53 165.48 13.98 Favored Pre-proline 0 CA--C 1.537 0.447 0 C-N-CA 125.704 1.602 . . . . 0.0 107.802 162.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -66.12 86.37 0.25 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.143 2.562 . . . . 0.0 110.019 170.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -141.23 175.03 9.97 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 130.347 3.459 . . . . 0.0 106.432 178.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.3 m -44.34 143.48 1.24 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 129.672 3.189 . . . . 0.0 111.932 172.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -87.89 14.43 8.85 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 172.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.29 75.07 9.89 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 1.3 m -133.88 154.86 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.592 0 C-N-CA 126.68 1.992 . . . . 0.0 107.758 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.82 154.81 79.75 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.867 0.867 . . . . 0.0 109.307 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.22 165.98 26.76 Favored 'Trans proline' 0 C--O 1.237 0.462 0 C-N-CA 122.821 2.347 . . . . 0.0 112.537 -173.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.28 165.17 7.12 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 125.635 1.574 . . . . 0.0 110.205 170.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -76.64 -178.17 4.3 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 123.312 2.675 . . . . 0.0 113.034 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 75.29 86.52 0.09 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 128.415 2.686 . . . . 0.0 113.392 163.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.0 t30 -115.2 144.27 31.87 Favored Pre-proline 0 N--CA 1.472 0.66 0 C-N-CA 124.533 1.133 . . . . 0.0 111.158 -174.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -84.8 -18.51 4.47 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 124.215 3.277 . . . . 0.0 112.577 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.81 -10.36 8.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.992 0.917 . . . . 0.0 113.022 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -101.38 -2.37 31.09 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 127.409 2.284 . . . . 0.0 112.611 -175.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 60.1 m -60.69 -57.21 13.67 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.098 1.317 . . . . 0.0 111.598 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.478 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -50.68 -18.14 0.65 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 178.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mp -80.78 5.25 16.42 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 125.125 1.37 . . . . 0.0 111.262 -179.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.9 mt -92.6 61.71 3.74 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 119.546 -1.971 . . . . 0.0 111.575 -173.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -127.24 -52.35 1.4 Allowed 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 118.764 0.711 . . . . 0.0 112.646 -178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -90.0 -4.79 57.24 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 118.919 0.781 . . . . 0.0 111.79 179.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.5 -177.1 2.1 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.487 1.115 . . . . 0.0 111.499 -173.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.3 m -142.95 -57.73 0.43 Allowed 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 120.082 -1.636 . . . . 0.0 112.845 177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 9.0 m95 69.83 165.68 0.27 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 126.342 1.857 . . . . 0.0 112.293 176.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.7 t -143.14 137.69 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 177.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -79.5 132.06 36.22 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 175.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.3 t -126.24 -17.05 5.31 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 112.47 0.544 . . . . 0.0 112.47 -176.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -158.38 158.35 34.08 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.653 1.115 . . . . 0.0 111.097 176.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -139.06 95.04 2.88 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.737 1.615 . . . . 0.0 108.672 -176.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.95 146.16 46.25 Favored 'General case' 0 CA--C 1.521 -0.161 0 O-C-N 121.441 -0.787 . . . . 0.0 110.439 174.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.41 ' HG2' ' CZ ' ' A' ' 41' ' ' ARG . 28.3 mt-30 -80.23 166.49 21.35 Favored 'General case' 0 N--CA 1.443 -0.815 0 C-N-CA 125.096 1.358 . . . . 0.0 109.645 166.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.29 14.68 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.84 2.056 . . . . 0.0 113.497 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -137.13 4.61 2.72 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.154 1.782 . . . . 0.0 111.94 177.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.94 -5.0 78.93 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.357 -1.464 . . . . 0.0 112.961 174.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.3 m -68.94 108.41 3.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 125.659 1.584 . . . . 0.0 108.971 171.322 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.74 129.82 41.12 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.007 -1.058 . . . . 0.0 109.957 163.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.41 ' CZ ' ' HG2' ' A' ' 35' ' ' GLN . 28.3 mtt85 -77.86 172.69 13.08 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.827 1.651 . . . . 0.0 110.71 174.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.42 136.18 33.96 Favored 'General case' 0 C--O 1.238 0.496 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 162.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.8 m -132.71 157.59 77.94 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.289 1.836 . . . . 0.0 108.486 172.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -71.86 123.9 9.72 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 121.753 1.635 . . . . 0.0 109.739 178.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -78.51 172.05 14.22 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 164.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.63 -51.65 62.39 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 124.095 0.958 . . . . 0.0 111.911 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -67.31 -14.42 62.9 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 53.3 mm-40 -68.96 -15.75 63.56 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 119.749 1.159 . . . . 0.0 110.884 174.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.94 -30.76 3.65 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 123.343 0.497 . . . . 0.0 112.876 160.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.65 85.13 4.91 Favored Pre-proline 0 N--CA 1.449 -0.494 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 -174.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -73.76 160.81 43.03 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.999 2.466 . . . . 0.0 112.708 -176.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.474 HG12 ' H ' ' A' ' 70' ' ' GLY . 16.5 mt -85.7 101.05 9.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 C-N-CA 124.479 1.111 . . . . 0.0 108.772 177.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -121.54 119.16 31.14 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 -174.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 50.6 tp -79.31 164.94 23.68 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 175.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 92.2 m -149.82 111.71 4.57 Favored 'General case' 0 C--N 1.331 -0.221 0 O-C-N 119.918 -1.739 . . . . 0.0 108.34 167.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -82.13 147.22 29.17 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 164.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.6 t -165.4 158.22 15.84 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 104.876 -2.268 . . . . 0.0 104.876 171.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 39.8 p -130.88 29.36 4.74 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 121.567 -0.708 . . . . 0.0 110.089 167.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 8.6 t -53.76 -44.96 70.44 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 124.01 0.924 . . . . 0.0 112.018 -170.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -14.09 62.77 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 123.623 0.769 . . . . 0.0 112.623 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.2 2.26 55.81 Favored Glycine 0 CA--C 1.525 0.662 0 C-N-CA 125.497 1.522 . . . . 0.0 112.902 175.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.0 174.48 6.18 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.492 1.646 . . . . 0.0 108.967 164.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.415 ' HB3' ' CE1' ' A' ' 78' ' ' TYR . 26.8 mtp85 -82.21 63.07 6.23 Favored 'General case' 0 CA--C 1.509 -0.602 0 C-N-CA 125.871 1.668 . . . . 0.0 109.176 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -66.35 157.99 30.35 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 162.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -128.31 156.32 43.23 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 149.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 9.2 p -126.84 171.72 11.01 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 166.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 173.97 178.71 44.11 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.339 -1.504 . . . . 0.0 109.339 168.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -111.87 129.73 56.06 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.6 p -130.21 118.52 21.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.328 1.451 . . . . 0.0 109.3 -176.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.474 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 57.45 -78.83 0.01 OUTLIER Glycine 0 CA--C 1.526 0.778 0 C-N-CA 126.826 2.155 . . . . 0.0 112.052 -179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.0 OUTLIER -138.67 0.32 2.01 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 170.191 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 67.6 m-80 -117.13 139.11 51.15 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 119.867 1.212 . . . . 0.0 109.587 175.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -70.75 154.93 41.39 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.57 -0.452 . . . . 0.0 109.889 161.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -138.15 164.96 27.85 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 125.399 1.479 . . . . 0.0 109.393 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -156.0 163.97 39.04 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.522 1.529 . . . . 0.0 108.469 177.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 156.56 -174.76 34.3 Favored Glycine 0 CA--C 1.524 0.61 0 C-N-CA 125.479 1.514 . . . . 0.0 109.331 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 3.9 p -84.14 159.57 21.06 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 117.587 0.694 . . . . 0.0 112.106 -174.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 87' ' ' PHE . 6.7 p90 -139.75 165.18 27.96 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 168.468 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.34 153.23 39.43 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.934 1.294 . . . . 0.0 110.78 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 83.6 mt -126.09 96.69 4.82 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 125.517 1.527 . . . . 0.0 109.62 -168.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.8 ptmt -159.81 171.61 19.17 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -171.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 56.52 23.3 7.42 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.29 1.436 . . . . 0.0 113.948 171.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.46 25.18 68.39 Favored Glycine 0 C--N 1.338 0.689 0 O-C-N 121.048 -1.032 . . . . 0.0 111.54 -175.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -144.87 161.63 38.82 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 118.428 1.114 . . . . 0.0 111.422 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 23.4 tp -78.86 157.19 28.37 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 107.303 -1.369 . . . . 0.0 107.303 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 11.8 p -148.96 159.07 44.54 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 120.553 -1.342 . . . . 0.0 108.509 164.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 78' ' ' TYR . 95.8 m-85 -133.03 165.27 25.14 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.578 1.151 . . . . 0.0 109.211 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -102.72 -156.2 25.37 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 173.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.9 t -56.76 95.04 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.355 1.062 . . . . 0.0 110.234 168.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mt -84.1 156.56 22.1 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 127.312 2.245 . . . . 0.0 109.66 167.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -171.14 166.81 39.96 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 111.051 -0.82 . . . . 0.0 111.051 165.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -162.62 -174.78 32.94 Favored Glycine 0 CA--C 1.526 0.758 0 N-CA-C 108.305 -1.918 . . . . 0.0 108.305 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.08 173.89 7.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.644 0.735 . . . . 0.0 110.61 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? -125.39 73.1 1.29 Allowed 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.276 1.431 . . . . 0.0 107.221 172.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 64.4 mtm -72.71 162.02 30.01 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.862 1.665 . . . . 0.0 109.01 172.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -106.55 133.43 51.25 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.286 1.034 . . . . 0.0 109.482 174.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.261 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 51.0 m -126.97 -9.35 6.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.107 0.963 . . . . 0.0 113.286 166.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 17.3 ptp 44.69 48.41 8.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.66 1.584 . . . . 0.0 113.123 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.3 p -135.68 156.45 77.49 Favored Pre-proline 0 C--O 1.239 0.537 0 C-N-CA 124.785 1.234 . . . . 0.0 110.372 177.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -71.95 -25.09 20.12 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 122.972 2.448 . . . . 0.0 111.85 176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -79.95 -19.36 70.33 Favored Glycine 0 C--N 1.34 0.777 0 CA-C-O 118.439 -1.201 . . . . 0.0 111.561 169.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.46 -63.5 2.61 Favored Glycine 0 CA--C 1.523 0.586 0 CA-C-N 119.492 1.646 . . . . 0.0 110.326 174.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -74.42 -3.42 30.42 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.859 1.059 . . . . 0.0 113.859 -165.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.8 tt -63.9 -18.14 21.89 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 O-C-N 121.725 -0.609 . . . . 0.0 111.673 167.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -46.53 -48.86 19.25 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 125.714 1.606 . . . . 0.0 111.302 176.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -54.34 -42.3 73.85 Favored Glycine 0 CA--C 1.528 0.87 0 CA-C-O 119.199 -0.778 . . . . 0.0 112.217 179.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.08 -37.12 61.66 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 117.989 0.895 . . . . 0.0 109.194 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.77 -44.83 96.12 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.192 0.597 . . . . 0.0 110.792 -174.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -61.72 -40.85 96.53 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 118.034 0.379 . . . . 0.0 109.983 175.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.19 -17.66 64.66 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.58 0.752 . . . . 0.0 112.573 177.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.38 2.8 37.18 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 127.32 2.248 . . . . 0.0 112.281 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 43.0 mt -93.5 -26.89 16.97 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.116 1.325 . . . . 0.0 112.514 176.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.16 -11.04 42.3 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.794 1.179 . . . . 0.0 112.552 -178.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -96.98 106.51 18.86 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 168.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -136.02 65.49 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.869 0 N-CA-C 104.834 -2.284 . . . . 0.0 104.834 172.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -69.2 -33.76 73.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 116.276 -1.821 . . . . 0.0 109.93 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.722 ' HB2' ' CG1' ' A' ' 131' ' ' VAL . 74.5 mtt-85 -129.03 172.63 11.19 Favored 'General case' 0 C--N 1.357 0.92 0 CA-C-N 121.803 2.092 . . . . 0.0 112.981 162.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 41.0 m -150.44 150.93 31.99 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.822 1.649 . . . . 0.0 106.734 175.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -136.3 106.47 0.56 Allowed Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 107.466 -2.254 . . . . 0.0 107.466 172.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 19.7 t -86.54 108.67 18.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 172.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.74 73.05 3.4 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 168.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.3 ttm -73.71 74.67 1.55 Allowed 'General case' 0 C--N 1.341 0.225 0 CA-C-O 122.717 1.246 . . . . 0.0 107.92 171.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.4 ttm180 -148.26 112.8 5.33 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 102.308 -3.219 . . . . 0.0 102.308 175.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.59 134.99 95.4 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-O 116.907 -1.521 . . . . 0.0 108.0 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -76.09 123.36 9.26 Favored 'Cis proline' 0 N--CA 1.451 -1.018 0 CA-C-N 120.847 1.338 . . . . 0.0 109.978 -2.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -61.72 149.57 39.32 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.297 1.046 . . . . 0.0 111.232 -173.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -138.54 163.69 31.34 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 126.487 1.915 . . . . 0.0 106.159 171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.92 167.49 16.55 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 122.733 1.254 . . . . 0.0 109.098 173.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -148.45 135.4 20.06 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 176.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -130.59 153.77 48.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 172.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.722 ' CG1' ' HB2' ' A' ' 117' ' ' ARG . 2.6 p -138.45 158.43 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.841 0 C-N-CA 119.854 -0.739 . . . . 0.0 111.812 175.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 136' ' ' ASP . 2.2 mp -103.64 158.22 16.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-O 122.5 1.143 . . . . 0.0 108.944 175.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.77 -21.12 66.48 Favored 'General case' 0 C--N 1.315 -0.911 0 C-N-CA 126.273 1.829 . . . . 0.0 110.841 -166.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 26.5 t30 -71.81 -35.62 70.01 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 128.351 2.66 . . . . 0.0 111.065 171.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 126.83 -2.97 7.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 126.485 1.993 . . . . 0.0 113.463 178.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.447 ' HB2' HD22 ' A' ' 132' ' ' LEU . 66.1 m-20 -68.01 110.46 3.93 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.193 -1.181 . . . . 0.0 108.363 -177.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 28.4 m -108.64 106.78 16.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.705 1.602 . . . . 0.0 109.483 -168.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.59 160.41 22.52 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.616 -1.303 . . . . 0.0 109.645 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 61.6 m -137.78 128.86 27.45 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.289 -1.507 . . . . 0.0 109.374 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -118.28 146.28 44.43 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.796 -1.093 . . . . 0.0 110.604 -175.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -88.19 151.85 22.39 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 166.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -66.77 135.41 53.93 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 159.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.2 t -136.49 113.97 10.92 Favored 'General case' 0 N--CA 1.442 -0.838 0 N-CA-C 103.756 -2.683 . . . . 0.0 103.756 158.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 4.9 p -126.21 12.95 7.71 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 125.321 1.448 . . . . 0.0 111.356 173.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.208 0 C-N-CA 123.851 0.86 . . . . 0.0 111.622 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 56.1 mt . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo -62.34 157.77 43.89 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 121.493 1.462 . . . . 0.0 110.342 173.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -165.28 155.82 13.71 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 127.136 2.174 . . . . 0.0 106.804 173.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.5 m170 -72.01 163.76 64.28 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 161.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -65.6 -22.46 58.14 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 121.722 1.614 . . . . 0.0 112.857 175.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -125.2 -4.95 7.32 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 129.754 3.222 . . . . 0.0 111.932 -168.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.7 m 66.23 -153.9 0.24 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 125.616 1.567 . . . . 0.0 111.273 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -141.25 12.09 2.17 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 122.448 1.118 . . . . 0.0 114.012 -171.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 43.83 63.97 1.42 Allowed 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 127.879 2.472 . . . . 0.0 114.861 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 89.8 t -117.63 131.57 69.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 122.045 0.926 . . . . 0.0 109.962 -177.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -60.79 151.43 72.81 Favored Pre-proline 0 CA--C 1.537 0.443 0 C-N-CA 125.686 1.594 . . . . 0.0 110.507 175.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -67.13 142.63 61.93 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.312 2.008 . . . . 0.0 112.183 -167.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.02 162.12 76.09 Favored Pre-proline 0 C--O 1.239 0.546 0 C-N-CA 127.542 2.337 . . . . 0.0 109.267 -175.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -75.2 167.33 27.08 Favored 'Trans proline' 0 N--CA 1.454 -0.852 0 C-N-CA 123.203 2.602 . . . . 0.0 111.062 172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 63.79 64.17 0.79 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.906 1.683 . . . . 0.0 112.159 167.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -127.86 147.85 64.7 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 123.87 0.868 . . . . 0.0 112.423 -167.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -68.49 -26.41 34.33 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 124.132 3.221 . . . . 0.0 112.09 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.06 -18.7 3.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.95 1.7 . . . . 0.0 112.587 173.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -120.09 18.81 12.36 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 126.615 1.966 . . . . 0.0 111.016 -174.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.429 HG21 ' HA ' ' A' ' 84' ' ' LYS . 14.7 m -112.24 -14.2 13.38 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.307 0.958 . . . . 0.0 112.62 178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.17 -10.09 59.15 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 120.569 -1.332 . . . . 0.0 113.076 177.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.41 16.32 20.49 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.06 0.944 . . . . 0.0 109.214 -175.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -82.66 14.37 3.19 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.145 1.778 . . . . 0.0 113.75 -177.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -76.0 -39.05 56.62 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 120.917 1.69 . . . . 0.0 112.033 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -122.63 -0.91 9.08 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -162.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.2 p -95.32 166.88 11.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.309 1.044 . . . . 0.0 111.642 -174.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.7 m -144.96 149.2 34.8 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.787 1.635 . . . . 0.0 109.515 -169.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.439 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 69.1 m95 -157.93 172.88 17.66 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.781 1.232 . . . . 0.0 112.137 -150.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.587 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.8 p -157.02 119.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 177.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.564 HD13 HD23 ' A' ' 138' ' ' LEU . 16.0 tp -60.71 127.86 33.75 Favored 'General case' 0 CA--C 1.514 -0.406 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.53 -11.87 3.5 Favored 'General case' 0 N--CA 1.45 -0.453 0 O-C-N 123.847 0.717 . . . . 0.0 111.527 177.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.52 151.28 32.43 Favored 'General case' 0 C--N 1.344 0.348 0 CA-C-N 119.607 1.094 . . . . 0.0 110.579 174.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.1 t90 -138.73 112.49 8.38 Favored 'General case' 0 C--N 1.333 -0.132 0 N-CA-C 106.238 -1.764 . . . . 0.0 106.238 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -96.42 139.95 31.78 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 173.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -70.04 171.17 9.97 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 160.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -63.99 -36.5 84.17 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 122.203 -0.311 . . . . 0.0 110.664 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.65 0.9 44.96 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.072 0.949 . . . . 0.0 111.601 -176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.67 -2.69 49.2 Favored Glycine 0 CA--C 1.522 0.502 0 CA-C-O 118.816 -0.991 . . . . 0.0 113.208 168.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 30.7 m -61.16 103.81 0.32 Allowed 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.061 1.344 . . . . 0.0 108.818 173.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.16 119.01 13.72 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 120.779 -1.201 . . . . 0.0 109.684 169.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 37.6 mtt180 -73.24 155.43 39.55 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.092 0.957 . . . . 0.0 109.469 170.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.99 141.35 43.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.843 -1.071 . . . . 0.0 108.421 163.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.9 m -138.96 158.59 69.49 Favored Pre-proline 0 CA--C 1.54 0.566 0 C-N-CA 125.638 1.575 . . . . 0.0 108.24 172.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -68.4 109.0 1.92 Allowed 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.07 1.846 . . . . 0.0 109.706 178.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.13 173.9 1.77 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.022 0.929 . . . . 0.0 110.5 174.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.77 -57.11 12.08 Favored 'General case' 0 C--O 1.232 0.17 0 O-C-N 121.263 -0.898 . . . . 0.0 110.37 170.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -71.61 -6.56 41.77 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -67.96 -13.45 62.18 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 119.867 1.212 . . . . 0.0 112.274 171.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 127.3 -72.66 0.46 Allowed Glycine 0 C--N 1.336 0.54 0 CA-C-N 119.732 1.151 . . . . 0.0 112.131 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -117.69 85.21 21.24 Favored Pre-proline 0 CA--C 1.539 0.541 0 C-N-CA 126.101 1.761 . . . . 0.0 109.691 -177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -73.01 163.77 37.4 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.346 2.697 . . . . 0.0 112.754 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 16.3 mt -87.16 87.84 2.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 C-N-CA 124.332 1.053 . . . . 0.0 108.741 177.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -106.27 130.14 54.18 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 104.213 -2.514 . . . . 0.0 104.213 -174.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 35.2 tp -114.39 139.29 49.61 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.848 1.659 . . . . 0.0 106.942 -176.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 7.0 m -125.81 137.73 53.79 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 168.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.5 128.47 56.35 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 167.573 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -169.74 177.29 4.53 Favored 'General case' 0 C--O 1.238 0.493 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 174.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 40.8 p -93.27 47.74 1.28 Allowed 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.344 1.858 . . . . 0.0 109.647 164.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 21.1 t -61.63 -51.96 66.34 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.069 -1.02 . . . . 0.0 110.03 -179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.416 HG23 ' H ' ' A' ' 62' ' ' GLN . 8.7 t -71.38 -25.23 62.27 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.794 -0.566 . . . . 0.0 111.069 177.297 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.33 0.01 29.6 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.471 1.51 . . . . 0.0 113.848 -167.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.416 ' H ' HG23 ' A' ' 60' ' ' THR . 8.8 mt-30 -118.14 154.92 31.33 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 125.907 1.683 . . . . 0.0 108.415 166.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.1 ptp85 -76.99 78.0 3.54 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 124.677 1.191 . . . . 0.0 109.809 -179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -130.45 163.85 26.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 122.487 1.136 . . . . 0.0 113.939 -173.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -105.02 100.42 10.01 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 125.89 1.676 . . . . 0.0 106.823 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -108.33 63.69 0.61 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-O 122.592 1.187 . . . . 0.0 111.446 -177.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -110.21 169.14 13.37 Favored Glycine 0 N--CA 1.467 0.763 0 C-N-CA 125.146 1.355 . . . . 0.0 111.324 -163.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.529 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 42.6 t80 -95.03 129.9 41.92 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 8.6 t -108.16 175.09 5.6 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 163.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.84 -29.77 2.14 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 127.36 2.41 . . . . 0.0 116.639 -156.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.5 t -135.65 -27.03 1.19 Allowed 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 118.757 1.278 . . . . 0.0 112.716 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -129.09 137.58 51.33 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 106.263 -1.754 . . . . 0.0 106.263 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.529 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 6.1 ptt180 -65.67 -174.74 0.23 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 113.82 -1.536 . . . . 0.0 110.43 170.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -149.91 168.48 23.66 Favored 'General case' 0 N--CA 1.435 -1.187 0 C-N-CA 124.103 0.961 . . . . 0.0 109.218 177.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -153.83 153.85 32.88 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 126.981 2.112 . . . . 0.0 105.965 167.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -164.59 -113.21 0.28 Allowed Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.498 -1.841 . . . . 0.0 108.498 164.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -144.82 168.25 20.67 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 126.745 2.018 . . . . 0.0 106.951 157.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 16.2 p90 -118.43 -179.23 3.72 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.719 1.208 . . . . 0.0 108.848 165.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -164.41 116.88 1.32 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.332 0.969 . . . . 0.0 111.256 172.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.4 mt -75.04 113.37 12.28 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.133 0.973 . . . . 0.0 109.203 -174.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -148.65 168.53 22.59 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 124.799 1.24 . . . . 0.0 108.116 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.8 t0 48.43 23.08 0.54 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 127.005 2.122 . . . . 0.0 116.064 172.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.442 ' O ' HG21 ' A' ' 118' ' ' THR . . . 67.53 20.49 71.87 Favored Glycine 0 C--N 1.34 0.799 0 CA-C-O 117.136 -1.925 . . . . 0.0 111.976 -172.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.429 ' HA ' HG21 ' A' ' 20' ' ' THR . 0.4 OUTLIER -128.11 170.73 12.61 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 128.074 2.55 . . . . 0.0 111.572 -176.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -113.6 99.58 7.84 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.351 -1.722 . . . . 0.0 106.351 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 6.0 m -97.92 157.56 16.03 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -122.2 175.76 6.21 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.075 1.35 . . . . 0.0 110.379 -174.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -110.25 -162.75 18.84 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 126.078 1.799 . . . . 0.0 109.483 172.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.2 t -59.01 115.13 2.94 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.209 -1.775 . . . . 0.0 106.209 163.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.03 155.78 18.39 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.889 1.275 . . . . 0.0 109.127 176.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 169.87 157.86 12.87 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 163.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -169.51 91.89 0.1 OUTLIER Glycine 0 CA--C 1.523 0.58 0 CA-C-N 119.187 1.493 . . . . 0.0 114.884 172.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 82.4 p 63.72 175.33 0.17 Allowed 'General case' 0 C--N 1.316 -0.88 0 C-N-CA 131.508 3.923 . . . . 0.0 112.004 -176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -137.86 53.4 1.84 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 125.921 1.689 . . . . 0.0 109.107 -176.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 42.2 mtm -61.62 170.74 1.79 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.184 0.994 . . . . 0.0 110.425 174.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.03 128.92 54.82 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.687 1.195 . . . . 0.0 110.414 -179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 74.3 m -134.28 101.47 5.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 126.446 1.898 . . . . 0.0 106.553 177.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 22.9 ptp -70.64 44.78 0.08 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.025 1.73 . . . . 0.0 113.22 -177.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 36.4 p -129.02 161.7 56.51 Favored Pre-proline 0 C--O 1.239 0.543 0 C-N-CA 125.855 1.662 . . . . 0.0 107.801 -169.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -64.06 -47.53 6.36 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.165 1.91 . . . . 0.0 110.085 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -75.43 -1.76 66.13 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.775 -1.014 . . . . 0.0 112.361 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -87.95 -42.07 6.1 Favored Glycine 0 C--N 1.336 0.559 0 CA-C-N 118.849 1.324 . . . . 0.0 110.547 175.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -85.34 -16.34 40.3 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.213 1.006 . . . . 0.0 112.818 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.9 tt -61.91 -15.34 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 123.771 0.829 . . . . 0.0 112.44 173.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -44.75 -47.51 10.78 Favored 'General case' 0 C--N 1.339 0.149 0 C-N-CA 125.604 1.561 . . . . 0.0 110.093 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -53.36 -47.61 61.87 Favored Glycine 0 C--N 1.338 0.694 0 CA-C-O 119.579 -0.567 . . . . 0.0 111.785 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.97 74.43 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 117.682 0.741 . . . . 0.0 110.876 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 46.2 t80 -65.86 -42.71 90.06 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.7 -0.625 . . . . 0.0 110.216 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -67.24 -14.3 62.78 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.751 -1.218 . . . . 0.0 112.016 173.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.45 -8.32 45.01 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 169.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -90.92 -37.31 13.62 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -173.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 18.4 mt -72.93 -4.83 34.57 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.708 -1.245 . . . . 0.0 112.067 -175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 76.9 p -78.08 -8.47 58.26 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.674 1.189 . . . . 0.0 111.54 168.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 79.7 m-70 -122.2 71.46 1.01 Allowed 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.549 1.94 . . . . 0.0 107.633 -174.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.8 mm -107.95 66.2 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 172.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -73.8 -42.27 61.21 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 116.624 -2.03 . . . . 0.0 110.334 173.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.8 mtm180 -121.72 172.82 7.86 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 126.009 1.724 . . . . 0.0 110.578 -178.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.442 HG21 ' O ' ' A' ' 83' ' ' GLY . 11.4 t -168.52 172.34 8.27 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -168.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 174.57 103.13 0.16 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 171.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 67.8 t -88.13 150.92 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 O-C-N 120.506 -1.585 . . . . 0.0 109.641 176.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.26 93.13 4.34 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.156 -1.424 . . . . 0.0 107.156 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 18.7 ttm -91.58 54.28 2.46 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 123.219 1.485 . . . . 0.0 110.052 177.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 21.2 ttm180 -135.55 126.11 26.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 104.245 -2.502 . . . . 0.0 104.245 170.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.82 128.6 93.81 Favored Pre-proline 0 N--CA 1.446 -0.659 0 CA-C-O 117.103 -1.427 . . . . 0.0 107.151 171.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -76.39 114.67 3.2 Favored 'Cis proline' 0 CA--C 1.539 0.749 0 O-C-N 123.531 1.279 . . . . 0.0 114.099 5.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -74.95 137.55 41.71 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.811 0.845 . . . . 0.0 110.778 -170.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -146.77 161.89 39.7 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.202 1.801 . . . . 0.0 108.0 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.33 148.66 27.78 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 171.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.1 mt-30 -129.42 133.58 47.41 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 121.311 0.577 . . . . 0.0 109.723 159.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.2 mt -117.65 148.5 41.9 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.775 1.23 . . . . 0.0 109.638 169.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 72.8 t -130.95 123.25 53.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 -171.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 12.0 mt -71.64 166.93 20.87 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -57.64 -21.79 41.77 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.135 1.374 . . . . 0.0 111.259 173.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -80.97 -23.65 38.63 Favored 'General case' 0 C--N 1.339 0.136 0 C-N-CA 126.366 1.866 . . . . 0.0 111.72 -179.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.74 -1.57 56.84 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 124.303 0.954 . . . . 0.0 113.448 -170.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.14 146.35 15.16 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.406 1.482 . . . . 0.0 108.623 170.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 7.4 m -135.56 102.84 5.24 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.63 1.172 . . . . 0.0 109.15 -163.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.564 HD23 HD13 ' A' ' 30' ' ' LEU . 7.1 mp -93.5 128.05 39.44 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.402 -1.436 . . . . 0.0 109.167 177.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 32.2 m -107.68 131.92 53.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.533 1.133 . . . . 0.0 108.154 177.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 15.7 m-85 -127.28 153.79 45.7 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.996 0.919 . . . . 0.0 110.625 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.587 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.5 OUTLIER -86.36 156.31 20.25 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 117.489 -1.243 . . . . 0.0 108.553 -175.424 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -85.88 95.35 9.43 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.987 1.721 . . . . 0.0 107.453 162.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 23.3 t -92.0 76.33 5.48 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 171.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 6.4 t -82.24 13.2 3.65 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 178.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 115.736 -2.078 . . . . 0.0 110.897 -172.408 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 3.8 mp . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.62 -174.14 0.67 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.415 2.743 . . . . 0.0 110.959 168.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.33 167.48 20.96 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 161.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . 0.266 34.4 p80 54.68 164.36 0.05 OUTLIER Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 127.274 2.23 . . . . 0.0 111.801 -168.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -79.97 -45.83 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 0 CA-C-N 120.5 1.214 . . . . 0.0 111.308 177.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -161.8 -176.59 5.34 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 130.336 3.454 . . . . 0.0 105.837 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.4 t -54.79 133.86 47.6 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 125.704 1.602 . . . . 0.0 109.99 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -142.64 78.08 1.6 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 106.402 -1.703 . . . . 0.0 106.402 169.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -162.27 74.17 0.41 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.992 0.917 . . . . 0.0 110.071 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.1 t -138.22 86.92 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 O-C-N 121.084 -1.01 . . . . 0.0 108.851 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . 60.58 165.11 0.1 OUTLIER Pre-proline 0 N--CA 1.471 0.59 0 C-N-CA 126.123 1.769 . . . . 0.0 112.531 -172.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.9 147.88 21.74 Favored 'Trans proline' 0 N--CA 1.454 -0.81 0 C-N-CA 122.469 2.113 . . . . 0.0 108.874 168.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.39 156.67 62.53 Favored Pre-proline 0 C--O 1.24 0.555 0 C-N-CA 123.573 0.749 . . . . 0.0 109.856 174.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -71.12 168.21 23.93 Favored 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 123.171 2.581 . . . . 0.0 110.306 178.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 66.78 33.35 6.21 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.162 1.785 . . . . 0.0 112.525 172.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.522 HD22 ' HB3' ' A' ' 18' ' ' ALA . 3.2 t30 -84.92 144.36 41.67 Favored Pre-proline 0 CA--C 1.537 0.443 0 CA-C-N 118.231 0.469 . . . . 0.0 112.065 -173.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -69.97 -23.28 30.03 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.761 2.308 . . . . 0.0 112.03 178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.522 ' HB3' HD22 ' A' ' 16' ' ' ASN . . . -63.73 -1.73 1.46 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.405 1.882 . . . . 0.0 114.345 -179.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -115.02 3.99 14.61 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.48 1.512 . . . . 0.0 112.004 -178.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.535 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.3 t -74.86 -12.24 60.33 Favored 'General case' 0 CA--C 1.556 1.183 0 O-C-N 121.447 -0.783 . . . . 0.0 111.119 -175.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -8.37 34.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 118.992 -2.318 . . . . 0.0 112.641 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.2 mt -105.9 21.08 17.9 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 124.337 1.055 . . . . 0.0 112.391 -167.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.535 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.1 mm? -110.08 62.5 0.6 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.264 1.826 . . . . 0.0 109.169 -175.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.2 p-10 -137.29 -41.03 0.57 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 123.689 0.796 . . . . 0.0 112.129 -163.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -136.41 16.76 3.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.354 1.073 . . . . 0.0 110.897 -177.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -98.7 170.24 8.92 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 129.191 2.997 . . . . 0.0 109.114 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 59.3 m -152.18 148.27 27.41 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 119.295 -2.128 . . . . 0.0 110.096 -174.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 28.0 m95 -148.78 175.3 11.35 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.067 1.347 . . . . 0.0 110.221 -162.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 75.9 t -146.29 127.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 107.349 -1.352 . . . . 0.0 107.349 -179.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -68.82 133.1 47.84 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 173.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 t -133.56 -9.92 2.81 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 174.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.591 ' HB3' ' HB ' ' A' ' 139' ' ' THR . . . -154.41 140.78 18.69 Favored 'General case' 0 C--N 1.339 0.143 0 O-C-N 120.629 -1.295 . . . . 0.0 109.351 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -135.28 98.76 4.05 Favored 'General case' 0 C--N 1.334 -0.106 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 177.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -82.82 136.61 34.59 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 120.447 -1.408 . . . . 0.0 107.312 174.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -66.97 163.83 18.94 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 157.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.63 -37.57 84.47 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.247 0.546 . . . . 0.0 111.033 -177.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.3 -12.63 59.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 122.776 0.43 . . . . 0.0 110.427 -175.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 119.46 -4.59 13.38 Favored Glycine 0 C--N 1.34 0.798 0 CA-C-O 118.317 -1.268 . . . . 0.0 114.276 169.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 48.5 m -73.22 107.75 5.72 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.894 1.847 . . . . 0.0 108.84 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -62.51 110.3 1.64 Allowed 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 123.631 0.772 . . . . 0.0 109.89 166.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 15.9 mtt180 -62.0 154.42 26.65 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.498 1.519 . . . . 0.0 110.308 172.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.66 132.61 47.82 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.0 m -138.87 156.35 72.73 Favored Pre-proline 0 C--O 1.239 0.54 0 C-N-CA 124.402 1.081 . . . . 0.0 109.876 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -70.15 108.69 2.21 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.45 2.1 . . . . 0.0 110.249 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.96 168.78 12.96 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.091 0.956 . . . . 0.0 111.033 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.26 -7.95 46.33 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.369 1.468 . . . . 0.0 112.836 170.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -118.51 9.92 12.46 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 127.304 2.242 . . . . 0.0 111.078 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -98.63 -10.35 23.44 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.298 -0.876 . . . . 0.0 112.346 172.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.59 -45.0 1.19 Allowed Glycine 0 C--N 1.335 0.509 0 C-N-CA 123.847 0.736 . . . . 0.0 114.312 170.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.87 79.53 27.33 Favored Pre-proline 0 C--N 1.323 -0.546 0 C-N-CA 127.032 2.133 . . . . 0.0 109.8 -170.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -66.22 158.41 54.97 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 123.135 2.557 . . . . 0.0 111.231 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 28.1 mt -90.22 113.54 26.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 C-N-CA 124.341 1.056 . . . . 0.0 108.229 179.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 30.9 p -119.06 140.72 49.58 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 -171.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 36.1 tp -125.5 140.48 52.73 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.13 1.372 . . . . 0.0 108.791 -177.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 20.7 m -134.8 129.35 34.41 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 125.707 1.603 . . . . 0.0 107.208 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.417 HD22 ' N ' ' A' ' 56' ' ' LEU . 1.8 mm? -118.75 122.95 43.66 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 178.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 t -168.63 -153.12 0.12 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.8 p -122.46 46.86 2.04 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.266 1.026 . . . . 0.0 112.545 177.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.22 -46.85 88.33 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 120.571 -1.331 . . . . 0.0 111.851 -173.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -77.89 1.39 20.67 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 120.07 -1.644 . . . . 0.0 112.342 173.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 88.78 -9.86 74.66 Favored Glycine 0 CA--C 1.526 0.736 0 O-C-N 120.079 -1.638 . . . . 0.0 113.119 -178.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -104.6 160.38 14.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 119.47 1.635 . . . . 0.0 108.962 164.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -64.33 91.27 0.07 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.839 0.856 . . . . 0.0 109.604 171.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -133.74 155.28 50.04 Favored 'General case' 0 N--CA 1.437 -1.105 0 CA-C-O 121.603 0.716 . . . . 0.0 110.021 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.79 146.78 26.62 Favored 'General case' 0 N--CA 1.437 -1.108 0 N-CA-C 107.486 -1.301 . . . . 0.0 107.486 175.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -125.62 151.95 45.81 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 154.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.45 177.92 48.06 Favored Glycine 0 N--CA 1.445 -0.763 0 O-C-N 121.222 -0.923 . . . . 0.0 112.227 -174.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -125.13 105.57 9.26 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 124.69 1.196 . . . . 0.0 107.994 -177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -85.03 -1.35 56.72 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 125.083 1.353 . . . . 0.0 113.915 -175.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 149.48 -74.71 0.27 Allowed Glycine 0 N--CA 1.448 -0.516 0 N-CA-C 109.374 -1.49 . . . . 0.0 109.374 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 18.0 t -151.05 14.78 0.72 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 118.513 1.157 . . . . 0.0 113.386 177.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -119.08 -6.01 10.47 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.081 -1.637 . . . . 0.0 112.327 172.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 52.65 178.38 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 125.515 1.526 . . . . 0.0 111.441 -162.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -151.72 153.28 34.04 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.558 167.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -145.41 161.25 40.13 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 126.692 1.997 . . . . 0.0 107.19 170.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.46 163.43 11.6 Favored Glycine 0 CA--C 1.523 0.58 0 N-CA-C 110.487 -1.045 . . . . 0.0 110.487 171.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 20.3 m -69.59 163.91 24.45 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.935 0.894 . . . . 0.0 111.329 -170.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -137.93 171.94 13.68 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 123.53 0.732 . . . . 0.0 111.598 172.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.06 150.38 31.65 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 125.881 1.672 . . . . 0.0 108.024 178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 70.1 mt -117.63 117.36 29.17 Favored 'General case' 0 CA--C 1.517 -0.318 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -164.44 168.4 18.5 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.753 1.221 . . . . 0.0 109.285 -178.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 27.0 t0 48.19 23.4 0.53 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 172.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.57 13.04 77.88 Favored Glycine 0 CA--C 1.529 0.961 0 O-C-N 120.085 -1.634 . . . . 0.0 113.148 -175.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.445 ' HB2' HG22 ' A' ' 115' ' ' ILE . 25.1 pttt -141.37 140.9 33.8 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 120.065 1.933 . . . . 0.0 112.164 -174.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.552 ' O ' HG21 ' A' ' 115' ' ' ILE . 14.8 tp -82.88 105.15 13.65 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 125.852 1.661 . . . . 0.0 108.697 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 72.9 m -106.88 159.05 16.55 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.789 0.804 . . . . 0.0 109.534 176.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.486 ' HB3' HD21 ' A' ' 90' ' ' LEU . 73.3 m-85 -115.59 -165.92 1.08 Allowed 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.69 1.196 . . . . 0.0 110.435 -167.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -112.37 -87.77 1.7 Allowed Glycine 0 C--N 1.334 0.433 0 O-C-N 120.717 -1.24 . . . . 0.0 110.085 -178.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.8 m -154.69 69.22 0.74 Allowed 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.696 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -61.92 164.2 6.76 Favored 'General case' 0 N--CA 1.437 -1.106 0 O-C-N 120.923 -1.111 . . . . 0.0 112.494 -173.219 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -177.3 -179.98 47.83 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 169.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.13 -158.25 7.57 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.505 1.05 . . . . 0.0 111.642 -171.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 58.7 p -88.32 178.98 6.43 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 166.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -128.28 59.16 1.52 Allowed 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.306 1.412 . . . . 0.0 110.724 173.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 32.9 mtm -59.19 165.06 2.77 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.493 161.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -109.93 153.33 24.66 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 166.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.271 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -134.71 159.64 40.65 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 123.629 0.771 . . . . 0.0 109.741 169.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -111.61 19.54 18.0 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 124.818 1.247 . . . . 0.0 110.772 177.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.4 p -96.49 165.09 16.8 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.125 1.77 . . . . 0.0 108.133 -178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.77 -42.06 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 122.261 1.974 . . . . 0.0 109.572 165.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.47 7.31 48.25 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-O 118.319 -1.267 . . . . 0.0 112.927 -175.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.82 -55.84 2.08 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 108.136 -1.986 . . . . 0.0 108.136 170.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.9 mt-30 -60.47 -27.03 67.23 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.871 0.868 . . . . 0.0 112.487 -174.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.6 tt -63.63 -17.91 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.581 0.752 . . . . 0.0 112.3 -178.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.04 -40.91 64.27 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 119.364 0.984 . . . . 0.0 110.404 174.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.57 -28.18 72.07 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-O 119.088 -0.84 . . . . 0.0 111.973 -178.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -80.42 -45.41 17.69 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 118.355 1.077 . . . . 0.0 110.031 171.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.14 -46.6 86.47 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.066 0.946 . . . . 0.0 111.115 -171.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.54 -47.46 69.97 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 118.422 0.556 . . . . 0.0 109.549 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.57 -32.49 74.11 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.044 0.538 . . . . 0.0 111.735 -177.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -65.21 -26.49 68.15 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.303 0.641 . . . . 0.0 111.357 174.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 77.4 mt -69.02 -12.11 61.39 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.997 0.817 . . . . 0.0 112.25 175.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 15.3 p -91.3 -4.57 55.74 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 119.327 0.967 . . . . 0.0 111.806 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -117.82 71.52 0.82 Allowed 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.552 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.9 mm -107.62 83.13 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 106.201 -1.778 . . . . 0.0 106.201 172.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -95.91 -28.87 14.48 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 119.365 -0.934 . . . . 0.0 112.257 166.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 26.4 mtp85 -130.16 166.54 20.04 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 122.493 1.14 . . . . 0.0 110.303 -177.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.9 m -162.81 170.02 18.94 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 -177.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -150.44 143.04 10.18 Favored Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 105.319 -3.113 . . . . 0.0 105.319 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 29.6 t -129.47 128.52 66.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 N-CA-C 104.775 -2.306 . . . . 0.0 104.775 174.047 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.01 88.82 2.82 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 107.125 -1.435 . . . . 0.0 107.125 -174.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.12 50.39 0.61 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.854 1.788 . . . . 0.0 111.659 -178.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -125.24 128.39 48.22 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.219 2.607 . . . . 0.0 104.358 170.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -57.22 136.3 80.97 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-O 117.204 -1.379 . . . . 0.0 107.684 147.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -72.67 121.89 7.01 Favored 'Cis proline' 0 N--CA 1.456 -0.703 0 CA-C-N 120.341 1.157 . . . . 0.0 110.825 -8.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -75.68 138.9 41.63 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.622 0.725 . . . . 0.0 110.884 -171.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -146.27 153.76 40.94 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 171.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 44.8 ttp -116.36 145.31 43.31 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.491 1.516 . . . . 0.0 107.675 176.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -133.65 102.81 5.62 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.384 0.993 . . . . 0.0 110.868 178.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 73.3 mt -80.62 148.88 30.08 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 66.0 t -131.72 128.47 60.3 Favored 'Isoleucine or valine' 0 C--O 1.233 0.229 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 -176.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 11.2 mt -81.49 156.49 25.27 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -50.75 -36.19 35.35 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.731 1.612 . . . . 0.0 112.454 177.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -87.75 -6.26 58.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.075 1.35 . . . . 0.0 111.27 -175.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.96 -4.22 14.18 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.93 1.729 . . . . 0.0 114.897 157.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.28 156.83 7.02 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 109.845 -178.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 27.2 m -140.0 97.76 3.31 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 121.299 -0.876 . . . . 0.0 109.548 -172.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.7 mp -83.36 142.58 30.93 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 170.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.591 ' HB ' ' HB3' ' A' ' 32' ' ' ALA . 35.7 m -127.85 129.6 47.2 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 125.82 1.648 . . . . 0.0 107.676 -173.27 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -129.42 121.66 27.8 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 124.619 1.168 . . . . 0.0 108.714 -167.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 -75.93 144.24 41.18 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 176.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 6.1 tpt180 -70.57 129.43 39.18 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 172.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 47.8 t -136.13 83.94 2.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 169.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -77.52 19.16 0.38 Allowed 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.202 1.401 . . . . 0.0 112.425 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.438 -1.057 0 CA-C-O 114.56 -2.638 . . . . 0.0 110.441 -167.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.4 mm . . . . . 0 N--CA 1.472 0.657 0 N-CA-C 106.909 -1.515 . . . . 0.0 106.909 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -97.12 77.57 0.08 OUTLIER 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 122.995 2.463 . . . . 0.0 111.245 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.45 77.67 0.22 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.423 1.489 . . . . 0.0 111.019 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 65.36 165.85 0.12 Allowed Pre-proline 0 CA--C 1.548 0.893 0 CA-C-N 114.575 -1.193 . . . . 0.0 110.796 -170.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.65 -4.98 15.11 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.679 2.253 . . . . 0.0 115.383 -166.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.82 69.44 0.68 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.449 2.3 . . . . 0.0 111.632 -166.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.2 m -63.78 14.08 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.355 2.662 . . . . 0.0 115.121 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -108.48 72.84 0.85 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.168 1.387 . . . . 0.0 108.203 -169.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.76 57.19 0.99 Allowed 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.879 -1.055 . . . . 0.0 111.069 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 60.1 t -130.55 136.13 59.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 174.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -125.46 153.5 72.44 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 123.579 0.752 . . . . 0.0 110.697 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -72.99 176.94 8.38 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 124.162 3.242 . . . . 0.0 111.067 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.42 151.47 69.16 Favored Pre-proline 0 C--O 1.241 0.639 0 C-N-CA 123.36 0.664 . . . . 0.0 110.115 177.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -78.5 163.47 26.97 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 123.958 3.106 . . . . 0.0 111.624 174.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -143.48 46.49 1.5 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 128.508 2.723 . . . . 0.0 106.874 -175.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.9 t30 42.03 75.41 0.62 Allowed Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 127.748 2.419 . . . . 0.0 114.25 164.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -60.3 -17.72 48.44 Favored 'Trans proline' 0 CA--C 1.545 1.063 0 C-N-CA 123.178 2.585 . . . . 0.0 114.856 -176.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.18 0.4 9.83 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 120.742 -1.224 . . . . 0.0 113.631 169.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.58 -26.19 54.8 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.998 1.719 . . . . 0.0 112.184 172.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.541 ' HA ' HD23 ' A' ' 23' ' ' LEU . 1.8 m -62.14 -30.03 70.76 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 120.324 1.42 . . . . 0.0 111.669 -160.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.54 ' H ' HE21 ' A' ' 21' ' ' GLN . 0.0 OUTLIER -69.51 -20.14 63.72 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.039 0.936 . . . . 0.0 113.088 177.422 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.47 -7.58 59.6 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.248 1.019 . . . . 0.0 110.797 177.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.541 HD23 ' HA ' ' A' ' 20' ' ' THR . 3.2 mm? -77.7 5.02 10.14 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.684 -0.635 . . . . 0.0 110.49 173.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -73.1 -20.68 60.9 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 127.433 2.293 . . . . 0.0 112.54 171.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -159.28 51.38 0.36 Allowed 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -163.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 p -153.09 139.13 18.21 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.128 -1.608 . . . . 0.0 109.673 177.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.3 m -84.5 -64.48 1.15 Allowed 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 114.039 1.125 . . . . 0.0 114.039 -166.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.408 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 15.8 m95 75.5 160.94 0.23 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 129.948 3.299 . . . . 0.0 115.369 179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.482 HG23 ' HA ' ' A' ' 53' ' ' THR . 6.0 p -150.19 115.54 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.498 -1.033 0 N-CA-C 114.831 1.419 . . . . 0.0 114.831 -179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.668 HD21 HD12 ' A' ' 138' ' ' LEU . 3.3 tm? -66.81 134.93 53.12 Favored 'General case' 0 N--CA 1.444 -0.741 0 O-C-N 124.044 0.84 . . . . 0.0 109.456 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.519 ' N ' HD13 ' A' ' 30' ' ' LEU . 3.9 t -144.06 -2.23 0.92 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 174.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -155.12 150.86 27.6 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 120.462 -1.399 . . . . 0.0 111.455 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.673 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -139.2 132.12 29.36 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 126.758 2.023 . . . . 0.0 105.988 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.28 135.21 53.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 126.969 2.107 . . . . 0.0 107.36 -176.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 11.5 mt-30 -78.13 170.2 17.01 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.221 0.534 . . . . 0.0 109.583 169.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.06 -15.71 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 179.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.07 3.82 44.58 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.756 1.223 . . . . 0.0 110.915 173.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 89.82 -7.72 81.22 Favored Glycine 0 C--N 1.342 0.875 0 C-N-CA 124.559 1.076 . . . . 0.0 112.784 175.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 44.5 m -60.94 105.15 0.43 Allowed 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 126.969 2.108 . . . . 0.0 109.883 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.11 111.82 6.04 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.619 0.767 . . . . 0.0 109.658 170.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 -67.07 155.02 39.77 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.656 0.783 . . . . 0.0 110.751 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -72.25 141.36 48.94 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 160.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 22.9 m -143.05 165.9 23.43 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 128.394 2.677 . . . . 0.0 105.63 174.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -64.42 124.66 13.68 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 CA-C-N 121.478 1.564 . . . . 0.0 108.516 168.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.77 153.86 42.38 Favored 'General case' 0 N--CA 1.441 -0.918 0 C-N-CA 123.843 0.857 . . . . 0.0 109.96 170.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.43 -41.78 98.96 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 121.961 -0.462 . . . . 0.0 110.751 175.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -75.48 2.26 12.02 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.215 1.006 . . . . 0.0 112.052 -176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -84.67 -19.09 33.39 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 118.507 -0.759 . . . . 0.0 111.166 168.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 150.73 -84.14 0.16 Allowed Glycine 0 C--N 1.339 0.709 0 CA-C-N 119.589 1.086 . . . . 0.0 111.703 173.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -120.25 85.23 35.95 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 124.289 1.035 . . . . 0.0 109.945 -169.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -64.12 175.46 3.19 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.684 2.922 . . . . 0.0 113.178 -178.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.488 HG12 ' H ' ' A' ' 70' ' ' GLY . 20.5 mt -85.08 76.82 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 C-N-CA 124.928 1.291 . . . . 0.0 109.32 -179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.482 ' HA ' HG23 ' A' ' 29' ' ' VAL . 0.7 OUTLIER -87.11 127.68 35.12 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 104.174 -2.528 . . . . 0.0 104.174 -176.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 61.2 tp -86.59 156.91 19.85 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 172.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -142.3 122.69 13.99 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 168.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.6 mt -117.89 114.3 23.02 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 177.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -164.58 -169.06 1.65 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.038 1.735 . . . . 0.0 108.271 177.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 10.9 p -130.77 27.7 4.92 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 120.883 -1.136 . . . . 0.0 114.023 -164.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 t -55.67 -49.02 74.03 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.157 -0.965 . . . . 0.0 112.28 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.3 t -70.5 5.71 1.7 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 119.773 1.17 . . . . 0.0 112.612 176.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 82.52 -5.6 73.0 Favored Glycine 0 CA--C 1.525 0.699 0 O-C-N 119.765 -1.835 . . . . 0.0 113.692 -179.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -115.49 152.51 32.83 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 118.976 1.388 . . . . 0.0 111.583 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 ptp85 -70.88 74.35 0.61 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.906 1.682 . . . . 0.0 110.385 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -130.51 147.61 52.22 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.199 -0.938 . . . . 0.0 110.093 -178.316 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.36 155.39 24.77 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 175.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -158.78 98.73 1.51 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.49 0.716 . . . . 0.0 109.127 159.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -101.25 -158.76 27.16 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.512 -1.035 . . . . 0.0 110.512 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.465 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 15.4 t80 -126.02 122.41 35.8 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 104.558 -2.386 . . . . 0.0 104.558 174.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.466 ' CB ' ' CZ ' ' A' ' 108' ' ' TYR . 18.7 t -117.15 100.22 7.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 121.886 2.13 . . . . 0.0 111.315 -179.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.488 ' H ' HG12 ' A' ' 52' ' ' ILE . . . 76.59 -71.99 2.03 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 125.498 1.523 . . . . 0.0 111.855 172.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 1.8 t -135.62 -2.1 2.46 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 125.094 1.358 . . . . 0.0 111.353 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -136.49 108.74 7.28 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.465 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -62.16 159.57 14.48 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 122.466 1.127 . . . . 0.0 110.954 162.438 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -139.64 174.25 10.7 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 112.117 -2.311 . . . . 0.0 108.324 -168.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -159.96 165.6 31.71 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.927 0.891 . . . . 0.0 109.862 173.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 151.96 165.22 12.9 Favored Glycine 0 CA--C 1.525 0.711 0 C-N-CA 124.772 1.177 . . . . 0.0 110.794 164.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 60.6 p -74.12 168.02 20.4 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 117.737 0.769 . . . . 0.0 110.778 -163.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -135.51 176.47 8.65 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 123.822 0.849 . . . . 0.0 112.304 170.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -150.48 149.54 30.12 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 126.326 1.85 . . . . 0.0 107.726 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.413 HD22 ' HB2' ' A' ' 23' ' ' LEU . 74.5 mt -128.42 78.67 1.86 Allowed 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.775 1.23 . . . . 0.0 108.419 -163.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -147.1 168.16 22.29 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 124.445 1.098 . . . . 0.0 109.512 -169.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.5 t70 56.81 25.07 9.89 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.043 0.937 . . . . 0.0 112.513 169.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.32 -11.39 37.83 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 126.084 1.802 . . . . 0.0 113.662 -175.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.8 pttt -121.21 137.25 54.76 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 120.841 2.321 . . . . 0.0 113.311 -163.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 38.4 tp -67.81 107.21 2.53 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 105.775 -1.935 . . . . 0.0 105.775 167.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 34.5 m -100.84 164.73 11.7 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 124.319 1.048 . . . . 0.0 109.211 176.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -137.21 147.72 46.02 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.703 0.801 . . . . 0.0 110.909 -175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -88.01 -154.31 27.27 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 126.269 1.89 . . . . 0.0 110.611 171.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 28.5 m -64.18 98.41 0.22 Allowed 'General case' 0 C--O 1.238 0.452 0 C-N-CA 123.3 0.64 . . . . 0.0 109.733 175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 60.5 mt -84.96 166.24 16.93 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 170.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 167.83 -171.81 42.4 Favored Glycine 0 CA--C 1.53 0.987 0 N-CA-C 108.236 -1.946 . . . . 0.0 108.236 171.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.46 -150.9 8.22 Favored Glycine 0 CA--C 1.532 1.14 0 CA-C-N 118.93 1.365 . . . . 0.0 112.854 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.2 p -85.11 171.15 12.25 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.437 1.495 . . . . 0.0 112.051 175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 27.6 mtt180 -130.04 62.03 1.57 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.572 1.149 . . . . 0.0 110.87 174.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 2.7 mtt -82.04 149.39 28.11 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.171 -0.955 . . . . 0.0 108.443 175.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -90.44 140.74 29.44 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.619 0.768 . . . . 0.0 110.855 -179.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -117.55 -21.95 8.34 Favored 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 172.218 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 68.25 19.23 9.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.753 1.221 . . . . 0.0 112.213 -178.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 81.2 p -120.59 155.5 56.73 Favored Pre-proline 0 CA--C 1.539 0.554 0 C-N-CA 126.44 1.896 . . . . 0.0 110.784 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.2 -28.57 47.99 Favored 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.543 2.162 . . . . 0.0 111.815 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -78.8 -8.41 87.77 Favored Glycine 0 N--CA 1.447 -0.576 0 CA-C-O 117.994 -1.448 . . . . 0.0 113.126 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.63 -47.74 9.75 Favored Glycine 0 CA--C 1.527 0.794 0 CA-C-N 119.74 1.77 . . . . 0.0 109.315 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -70.21 -24.05 63.04 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 118.072 0.936 . . . . 0.0 113.367 -167.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.9 tt -64.49 -9.1 5.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 O-C-N 121.679 -0.638 . . . . 0.0 112.276 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.454 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 8.3 tm-20 -61.47 -16.09 43.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 127.366 2.266 . . . . 0.0 111.848 170.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -83.71 -29.05 33.34 Favored Glycine 0 CA--C 1.525 0.672 0 O-C-N 120.079 -1.638 . . . . 0.0 112.947 170.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -77.65 -47.09 20.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.713 1.256 . . . . 0.0 109.621 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.802 ' CZ ' HD13 ' A' ' 109' ' ' LEU . 0.3 OUTLIER -61.09 -37.45 82.79 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 122.965 0.506 . . . . 0.0 111.524 -162.149 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.802 HD13 ' CZ ' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -69.96 -47.28 62.93 Favored 'General case' 0 N--CA 1.462 0.17 0 C-N-CA 126.571 1.948 . . . . 0.0 109.386 179.419 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.55 -14.15 56.22 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.402 1.081 . . . . 0.0 113.062 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -94.97 -28.97 14.88 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.057 1.343 . . . . 0.0 111.502 174.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 31.6 mt -71.59 -8.93 57.11 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 120.683 -1.261 . . . . 0.0 113.194 179.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 9.9 p -80.56 -9.94 59.76 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.17 0.895 . . . . 0.0 112.338 171.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.3 m-70 -122.35 71.05 1.0 Allowed 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 125.208 1.403 . . . . 0.0 109.759 -168.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.4 mm -103.61 54.16 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -28.42 69.89 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.803 -0.56 . . . . 0.0 111.048 177.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -141.14 166.23 25.34 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.665 1.586 . . . . 0.0 110.266 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 6.2 t -160.05 161.93 34.06 Favored 'General case' 0 C--O 1.239 0.524 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 -169.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -158.22 83.61 0.14 Allowed Glycine 0 CA--C 1.524 0.651 0 CA-C-O 119.799 -0.445 . . . . 0.0 113.286 175.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.5 p -91.14 97.19 6.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.684 1.742 . . . . 0.0 111.83 170.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.72 98.63 9.78 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 124.493 1.117 . . . . 0.0 108.512 171.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 3.0 mtt -86.32 30.57 0.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.411 1.484 . . . . 0.0 114.415 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.02 89.85 3.21 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 120.292 -1.505 . . . . 0.0 110.7 -166.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -36.53 120.56 0.76 Allowed Pre-proline 0 C--O 1.237 0.404 0 C-N-CA 126.441 1.897 . . . . 0.0 112.652 -166.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -69.06 126.68 9.24 Favored 'Cis proline' 0 N--CA 1.459 -0.554 0 CA-C-N 119.908 1.003 . . . . 0.0 111.724 1.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -83.84 145.04 28.87 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -140.32 179.61 6.55 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 165.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 5.0 tmm? -132.93 147.65 52.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 162.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -119.04 151.12 38.81 Favored 'General case' 0 N--CA 1.439 -1.003 0 C-N-CA 126.266 1.826 . . . . 0.0 108.0 170.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 90.5 mt -114.44 153.44 29.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 113.541 -1.663 . . . . 0.0 106.724 155.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 41.9 t -140.49 118.98 10.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 173.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 39.5 mt -76.18 173.65 11.07 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 122.288 1.042 . . . . 0.0 110.933 178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 14.9 p-10 -57.56 -17.62 15.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.267 1.427 . . . . 0.0 113.355 158.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -78.5 -2.44 38.66 Favored 'General case' 0 C--O 1.232 0.177 0 C-N-CA 124.862 1.265 . . . . 0.0 110.074 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.38 16.96 78.75 Favored Glycine 0 N--CA 1.444 -0.786 0 C-N-CA 124.074 0.845 . . . . 0.0 112.457 -178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -173.24 0.44 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 123.831 0.852 . . . . 0.0 112.237 -176.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 31.4 m -148.79 125.66 11.23 Favored 'General case' 0 N--CA 1.461 0.125 0 O-C-N 119.165 -2.21 . . . . 0.0 108.189 159.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.673 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.5 OUTLIER -105.48 161.2 14.55 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.094 0.958 . . . . 0.0 108.485 170.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 30' ' ' LEU . 42.1 m -143.08 123.33 13.77 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.297 0.639 . . . . 0.0 110.515 -168.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.439 ' CZ ' HD23 ' A' ' 30' ' ' LEU . 66.6 m-85 -125.88 143.6 51.01 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 126.327 1.851 . . . . 0.0 110.981 -172.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -80.45 164.9 22.68 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-N 119.612 1.096 . . . . 0.0 108.813 175.707 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.448 ' HE ' HG21 ' A' ' 144' ' ' THR . 6.5 tpt180 -87.62 97.72 11.02 Favored 'General case' 0 CA--C 1.53 0.182 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 156.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 22.7 t -109.62 52.87 0.71 Allowed 'General case' 0 C--O 1.219 -0.516 0 O-C-N 120.955 -1.09 . . . . 0.0 108.552 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . 0.448 HG21 ' HE ' ' A' ' 142' ' ' ARG . 1.4 t -76.88 8.02 4.18 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 121.372 -0.83 . . . . 0.0 111.987 176.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.248 0.977 0 C-N-CA 124.062 0.945 . . . . 0.0 109.732 -173.824 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 22.9 mm . . . . . 0 N--CA 1.477 0.896 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -68.33 -179.89 2.55 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 122.496 2.13 . . . . 0.0 110.225 169.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.7 ptpm? -76.04 156.83 33.61 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 162.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 51.5 m-70 -131.13 165.21 36.79 Favored Pre-proline 0 C--N 1.324 -0.519 0 C-N-CA 126.843 2.057 . . . . 0.0 105.727 172.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -70.54 -22.76 28.08 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 121.27 1.314 . . . . 0.0 111.866 168.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 13.5 t0 56.81 162.57 0.02 OUTLIER 'General case' 0 C--O 1.234 0.259 0 C-N-CA 128.828 2.851 . . . . 0.0 112.125 -156.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 23.5 m -166.28 173.02 10.49 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.23 1.812 . . . . 0.0 108.695 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -74.39 18.31 0.16 Allowed 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.431 -0.793 . . . . 0.0 112.221 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -81.07 38.84 0.48 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.374 1.469 . . . . 0.0 112.572 -169.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.4 p -144.99 117.87 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 126.153 1.781 . . . . 0.0 106.884 -178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.52 157.99 75.78 Favored Pre-proline 0 CA--C 1.541 0.609 0 O-C-N 121.731 -0.606 . . . . 0.0 110.61 173.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -79.65 168.71 19.24 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 122.781 2.321 . . . . 0.0 112.062 -179.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.03 160.11 41.39 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 125.535 1.534 . . . . 0.0 111.978 -177.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -74.65 -174.58 1.92 Allowed 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 124.653 3.568 . . . . 0.0 111.516 -176.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 49.65 74.5 0.2 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.538 1.935 . . . . 0.0 113.263 167.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -131.16 144.78 54.92 Favored Pre-proline 0 N--CA 1.469 0.51 0 C-N-CA 123.841 0.856 . . . . 0.0 111.202 -166.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.15 -12.0 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.64 0 C-N-CA 123.175 2.583 . . . . 0.0 112.257 177.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.95 -2.1 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 O-C-N 120.788 -1.195 . . . . 0.0 113.002 165.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -121.6 21.93 10.74 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.909 2.083 . . . . 0.0 110.818 172.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 41.4 m -84.8 -62.55 1.52 Allowed 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.945 1.248 . . . . 0.0 113.949 169.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.546 ' NE2' ' H ' ' A' ' 21' ' ' GLN . 0.5 OUTLIER -61.43 -26.09 67.65 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 121.081 1.764 . . . . 0.0 115.237 -160.27 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.73 -6.11 48.96 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.838 1.655 . . . . 0.0 111.168 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 90.9 mt -67.14 17.31 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.689 1.196 . . . . 0.0 111.963 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.03 -11.25 44.71 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.007 1.723 . . . . 0.0 112.054 171.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -128.11 -12.04 5.23 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.652 1.352 . . . . 0.0 114.652 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.418 HG22 ' NH2' ' A' ' 142' ' ' ARG . 75.0 p -82.62 170.25 15.36 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.593 -0.692 . . . . 0.0 111.839 -172.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 t -144.64 148.95 34.91 Favored 'General case' 0 CA--C 1.514 -0.411 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 -178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -153.14 165.63 35.05 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 125.209 1.404 . . . . 0.0 108.98 -164.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 74.3 t -143.04 120.66 6.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.054 -1.461 . . . . 0.0 107.054 -178.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.5 tp -62.75 132.77 53.34 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 9.0 t -139.21 -14.12 1.15 Allowed 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.078 0.769 . . . . 0.0 113.078 -177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -147.75 159.43 43.82 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.916 1.234 . . . . 0.0 109.337 166.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -142.06 93.96 2.61 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 176.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -72.02 133.96 45.6 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 171.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 -65.02 164.41 12.85 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 156.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.31 -27.1 65.57 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 122.937 0.495 . . . . 0.0 111.992 -172.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.21 -18.43 23.47 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 124.327 1.051 . . . . 0.0 112.529 -174.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 127.37 -6.05 7.16 Favored Glycine 0 CA--C 1.527 0.827 0 N-CA-C 115.082 0.793 . . . . 0.0 115.082 176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -69.27 103.62 2.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 119.362 1.581 . . . . 0.0 108.72 176.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 122.75 18.39 Favored 'General case' 0 C--N 1.33 -0.269 0 O-C-N 121.196 -0.94 . . . . 0.0 108.977 170.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 34.8 mtt180 -75.89 153.3 36.82 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.597 1.559 . . . . 0.0 110.312 174.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.56 125.5 26.72 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 123.775 0.83 . . . . 0.0 109.97 168.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.0 m -131.29 155.31 81.68 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 126.139 1.776 . . . . 0.0 108.028 173.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.49 120.88 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.568 2.178 . . . . 0.0 110.802 -178.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.88 168.03 8.65 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 121.346 -0.846 . . . . 0.0 111.913 164.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.28 -32.04 64.19 Favored 'General case' 0 CA--C 1.532 0.25 0 O-C-N 121.346 -0.846 . . . . 0.0 111.757 167.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -84.39 -13.3 52.61 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 121.63 -0.669 . . . . 0.0 112.517 179.035 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 80.1 mm-40 -75.49 -17.7 60.04 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.514 0.726 . . . . 0.0 112.114 178.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 126.95 -22.72 5.68 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 123.735 0.683 . . . . 0.0 114.131 163.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.64 85.47 3.68 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.397 1.099 . . . . 0.0 111.087 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -68.84 154.26 71.38 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.93 1.753 . . . . 0.0 111.578 178.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 46.6 mt -87.48 103.22 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 127.382 2.273 . . . . 0.0 108.23 -179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 38.7 p -123.88 135.68 53.87 Favored 'General case' 0 C--O 1.241 0.626 0 C-N-CA 124.872 1.269 . . . . 0.0 109.336 -164.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 29.5 tp -128.88 135.52 49.18 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.452 1.901 . . . . 0.0 109.432 -167.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 14.0 m -146.35 115.27 6.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 -171.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -104.51 112.21 25.18 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.6 t -161.02 -174.5 4.41 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -177.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.3 p -93.75 35.42 1.14 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.969 0.908 . . . . 0.0 112.178 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.7 t -50.49 -55.27 16.74 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 119.856 1.207 . . . . 0.0 114.191 -161.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -94.0 8.8 40.06 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.572 1.078 . . . . 0.0 110.669 177.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.48 -24.51 5.25 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.199 1.381 . . . . 0.0 114.615 165.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.4 166.37 14.2 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 128.111 2.565 . . . . 0.0 109.288 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.426 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 3.9 ptp85 -66.94 97.01 0.46 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.676 -1.147 . . . . 0.0 109.71 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -140.5 170.86 15.0 Favored 'General case' 0 N--CA 1.434 -1.257 0 CA-C-O 123.839 1.78 . . . . 0.0 113.002 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -108.91 75.18 0.94 Allowed 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 112.036 -2.347 . . . . 0.0 107.131 -175.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.91 86.61 4.79 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 174.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -128.68 179.49 16.58 Favored Glycine 0 CA--C 1.507 -0.415 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 -165.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 16.2 t80 -118.51 140.03 50.51 Favored 'General case' 0 N--CA 1.446 -0.666 0 CA-C-O 121.855 0.836 . . . . 0.0 109.061 177.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -144.99 135.1 23.93 Favored 'General case' 0 N--CA 1.437 -1.103 0 C-N-CA 128.49 2.716 . . . . 0.0 104.757 -171.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 44.14 -91.83 0.01 OUTLIER Glycine 0 CA--C 1.524 0.608 0 C-N-CA 127.514 2.483 . . . . 0.0 112.465 179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.4 t -152.63 33.1 0.5 Allowed 'General case' 0 C--O 1.234 0.279 0 CA-C-O 122.721 1.248 . . . . 0.0 111.572 162.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -125.03 -7.17 7.19 Favored 'General case' 0 C--N 1.321 -0.639 0 O-C-N 120.547 -1.346 . . . . 0.0 114.012 -174.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 ptt180 44.89 177.52 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 129.114 2.966 . . . . 0.0 113.106 -175.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -154.95 159.21 40.24 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.343 -1.299 . . . . 0.0 111.117 -177.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -163.21 160.0 23.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.746 1.618 . . . . 0.0 108.61 173.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 170.82 -86.06 0.08 OUTLIER Glycine 0 CA--C 1.527 0.822 0 CA-C-O 119.479 -0.623 . . . . 0.0 112.274 163.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 1.8 p -164.56 162.21 21.56 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 126.585 1.954 . . . . 0.0 110.099 -178.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.426 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 37.7 p90 -143.99 171.71 13.87 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.099 0.96 . . . . 0.0 110.876 165.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -149.48 142.15 24.53 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 126.161 1.784 . . . . 0.0 108.617 172.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -102.09 93.36 5.2 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 122.179 0.99 . . . . 0.0 109.762 176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -124.16 176.75 6.2 Favored 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 126.653 1.981 . . . . 0.0 108.695 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 52.81 14.11 0.4 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.41 2.284 . . . . 0.0 116.078 174.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 56.38 35.77 67.18 Favored Glycine 0 CA--C 1.53 1.031 0 O-C-N 120.082 -1.636 . . . . 0.0 111.856 -163.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 23.1 pttt -142.66 177.31 8.39 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 127.015 2.126 . . . . 0.0 112.353 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -87.13 139.9 30.1 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 171.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 10.1 p -131.91 148.38 52.53 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.448 1.476 . . . . 0.0 109.948 161.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.435 ' CB ' HD11 ' A' ' 90' ' ' LEU . 97.4 m-85 -112.88 157.66 21.15 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 124.286 1.034 . . . . 0.0 109.79 178.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -87.95 -153.43 25.72 Favored Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.646 1.117 . . . . 0.0 112.047 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.37 86.83 0.18 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.442 1.897 . . . . 0.0 108.694 170.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.468 HD13 HD23 ' A' ' 112' ' ' LEU . 67.2 mt -79.52 173.44 12.58 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 120.995 -1.066 . . . . 0.0 111.605 -175.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 159.01 179.42 33.84 Favored Glycine 0 CA--C 1.525 0.717 0 N-CA-C 110.082 -1.207 . . . . 0.0 110.082 170.524 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.09 -109.77 0.43 Allowed Glycine 0 C--N 1.333 0.384 0 C-N-CA 125.166 1.365 . . . . 0.0 111.01 -171.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -155.61 159.49 39.67 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 125.796 1.638 . . . . 0.0 107.958 177.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -103.14 38.37 1.77 Allowed 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 125.591 1.556 . . . . 0.0 110.371 -174.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 25.7 mtm -59.85 162.54 5.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.164 0.986 . . . . 0.0 109.549 176.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -107.17 144.14 34.35 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 174.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.1 OUTLIER -125.49 -15.85 6.0 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 125.343 1.457 . . . . 0.0 112.963 176.568 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.259 18.1 ptp 46.39 44.57 12.94 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.186 1.794 . . . . 0.0 112.419 -174.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 80.0 p -132.55 157.43 78.34 Favored Pre-proline 0 C--O 1.239 0.527 0 C-N-CA 125.417 1.487 . . . . 0.0 109.58 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -70.79 -27.69 21.25 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 121.533 1.488 . . . . 0.0 112.045 173.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.472 ' O ' HG22 ' A' ' 104' ' ' ILE . . . -63.9 -36.1 92.85 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 169.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -62.08 -35.28 91.23 Favored Glycine 0 C--N 1.335 0.519 0 CA-C-N 120.096 1.948 . . . . 0.0 113.304 -170.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -86.12 -13.56 46.81 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.036 0.918 . . . . 0.0 112.85 -175.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.472 HG22 ' O ' ' A' ' 101' ' ' GLY . 9.7 tt -68.31 -9.9 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 118.918 0.781 . . . . 0.0 111.22 -178.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -44.74 -51.3 9.46 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.824 0.85 . . . . 0.0 110.899 166.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.7 -39.01 92.99 Favored Glycine 0 C--N 1.337 0.639 0 CA-C-O 119.089 -0.84 . . . . 0.0 111.381 -173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -70.41 -45.83 65.16 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.475 0.71 . . . . 0.0 110.256 175.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -63.64 -45.12 91.63 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.781 0.832 . . . . 0.0 110.91 -171.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 72.0 mt -62.72 -36.37 82.78 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 119.197 0.908 . . . . 0.0 109.827 173.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.12 -17.78 64.76 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.079 1.352 . . . . 0.0 113.143 175.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -95.03 -33.06 12.85 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.776 1.23 . . . . 0.0 110.658 178.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.468 HD23 HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -63.85 -21.44 66.44 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.546 1.538 . . . . 0.0 112.084 176.095 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 7.7 p -81.64 -9.42 59.67 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.478 1.511 . . . . 0.0 112.842 177.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 87.9 m-70 -133.46 65.66 1.58 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 -175.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.0 mm -89.15 69.98 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.507 0 N-CA-C 103.413 -2.81 . . . . 0.0 103.413 163.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -73.27 -44.94 58.4 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 118.785 -1.166 . . . . 0.0 109.044 178.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.5 mtm180 -122.07 168.19 12.25 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 126.222 1.809 . . . . 0.0 109.767 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.2 t -163.67 170.9 16.41 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 120.853 -1.154 . . . . 0.0 108.482 -167.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -177.65 104.25 0.19 Allowed Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.232 -1.147 . . . . 0.0 110.232 175.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 2.3 p -113.13 142.87 24.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 O-C-N 121.144 -1.209 . . . . 0.0 109.598 179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -120.75 78.91 1.43 Allowed 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 125.888 1.675 . . . . 0.0 106.745 -171.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 48.1 ttm -76.09 62.85 1.73 Allowed 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.337 -0.852 . . . . 0.0 109.381 171.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 14.1 tpp180 -147.23 104.97 3.71 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -45.37 125.51 5.91 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-O 117.563 -1.208 . . . . 0.0 109.988 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.66 124.0 8.77 Favored 'Cis proline' 0 N--CA 1.459 -0.553 0 CA-C-N 119.95 1.018 . . . . 0.0 111.629 3.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -79.0 134.6 36.79 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -141.43 162.39 35.59 Favored 'General case' 0 C--O 1.238 0.457 0 N-CA-C 106.711 -1.588 . . . . 0.0 106.711 163.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 12.6 tmm? -127.06 147.52 50.15 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 126.133 1.773 . . . . 0.0 106.247 172.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.7 tt0 -146.18 128.06 15.41 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -171.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 74.7 mt -114.3 151.36 33.05 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 121.47 -0.769 . . . . 0.0 109.122 -178.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.42 117.6 47.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 -177.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.3 mp -68.73 169.21 11.72 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.783 0.801 . . . . 0.0 110.865 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -53.57 -33.26 54.13 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.584 1.554 . . . . 0.0 112.058 172.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 17.5 p30 -84.19 -27.38 28.07 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.478 -0.764 . . . . 0.0 112.148 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.37 -5.17 10.17 Favored Glycine 0 CA--C 1.533 1.179 0 CA-C-O 117.856 -1.524 . . . . 0.0 115.179 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -52.33 127.46 22.27 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.56 1.68 . . . . 0.0 108.771 -179.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.2 m -105.5 98.14 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.918 1.287 . . . . 0.0 109.17 -170.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 7.3 mp -83.21 142.62 31.03 Favored 'General case' 0 N--CA 1.469 0.512 0 O-C-N 120.496 -1.377 . . . . 0.0 108.608 175.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 54.4 m -123.73 132.04 53.73 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 124.492 1.117 . . . . 0.0 109.888 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -128.76 133.6 48.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.586 1.554 . . . . 0.0 109.384 -175.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.62 158.87 20.74 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 167.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.418 ' NH2' HG22 ' A' ' 26' ' ' THR . 10.9 tpt180 -84.16 133.97 34.59 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.593 -1.262 . . . . 0.0 107.593 173.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -117.23 65.92 0.73 Allowed 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 173.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 7.3 t -74.81 -1.04 20.35 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 16.2 ttm180 . . . . . 0 C--O 1.25 1.106 0 C-N-CA 124.464 1.105 . . . . 0.0 111.569 -167.913 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 33.8 mm . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -62.78 173.03 4.03 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 N-CA-C 108.417 -1.417 . . . . 0.0 108.417 152.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -112.63 166.01 11.73 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 165.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -62.51 161.51 26.29 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 123.52 0.512 . . . . 0.0 110.409 167.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -79.75 -5.97 14.14 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 123.464 2.776 . . . . 0.0 112.784 170.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -141.87 -159.43 0.97 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 128.086 2.554 . . . . 0.0 105.707 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.8 t -64.55 162.47 15.4 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.7 1.136 . . . . 0.0 111.142 177.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 97.6 mt-10 -108.66 14.88 24.15 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.524 1.53 . . . . 0.0 111.156 -177.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.82 70.43 6.35 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 126.035 1.734 . . . . 0.0 111.019 -171.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 97.9 t -102.95 114.68 43.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 C-N-CA 126.41 1.884 . . . . 0.0 106.902 177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.95 151.14 93.95 Favored Pre-proline 0 CA--C 1.541 0.6 0 C-N-CA 122.745 0.418 . . . . 0.0 110.239 176.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -80.28 179.44 6.15 Favored 'Trans proline' 0 N--CA 1.45 -1.064 0 C-N-CA 123.449 2.766 . . . . 0.0 112.237 -176.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -54.86 145.86 40.15 Favored Pre-proline 0 C--O 1.242 0.69 0 C-N-CA 125.874 1.67 . . . . 0.0 112.458 -172.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -74.92 179.41 6.09 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.74 2.96 . . . . 0.0 111.654 174.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 57.96 170.66 0.05 Allowed 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.014 1.725 . . . . 0.0 110.309 -165.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.505 HD22 ' HB3' ' A' ' 18' ' ' ALA . 15.7 t30 -166.11 148.25 6.14 Favored Pre-proline 0 C--O 1.238 0.454 0 O-C-N 121.161 -0.962 . . . . 0.0 108.581 166.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -63.26 -26.61 71.93 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.753 2.302 . . . . 0.0 111.276 173.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.505 ' HB3' HD22 ' A' ' 16' ' ' ASN . . . -69.13 4.11 1.78 Allowed 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 175.421 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.529 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -99.52 -13.99 19.24 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 120.138 1.335 . . . . 0.0 111.126 165.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -83.46 -20.11 34.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.696 1.134 . . . . 0.0 112.883 -172.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -8.5 33.33 Favored 'General case' 0 N--CA 1.468 0.432 0 O-C-N 120.577 -1.327 . . . . 0.0 113.572 176.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -97.79 13.78 29.29 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.374 1.07 . . . . 0.0 109.867 -177.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -81.81 31.25 0.36 Allowed 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.007 -1.058 . . . . 0.0 110.543 177.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -85.04 -54.53 4.58 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.403 0.681 . . . . 0.0 110.044 174.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -118.39 2.65 11.88 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.8 1.64 . . . . 0.0 113.398 -173.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.8 p -78.97 156.33 28.53 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 123.229 1.49 . . . . 0.0 111.344 -177.344 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -134.66 154.54 51.48 Favored 'General case' 0 N--CA 1.441 -0.925 0 O-C-N 120.332 -1.48 . . . . 0.0 109.063 -177.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.499 ' HD1' HD12 ' A' ' 54' ' ' LEU . 32.3 m95 -152.9 162.18 41.62 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -164.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 59.9 t -144.66 132.82 17.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.533 HD11 ' CD1' ' A' ' 138' ' ' LEU . 12.0 tp -81.15 150.95 28.49 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -173.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.6 t -139.22 -23.4 0.9 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.62 161.15 43.13 Favored 'General case' 0 N--CA 1.464 0.258 0 O-C-N 120.227 -1.546 . . . . 0.0 110.224 172.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.615 ' CG ' HD21 ' A' ' 138' ' ' LEU . 1.3 t90 -140.31 139.28 35.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.772 1.629 . . . . 0.0 107.315 169.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.99 135.99 54.0 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.739 1.616 . . . . 0.0 109.683 177.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -69.19 160.89 30.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.158 0.983 . . . . 0.0 109.191 163.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.01 73.64 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.615 0.766 . . . . 0.0 111.977 172.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -76.89 -4.13 42.2 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 121.612 -0.68 . . . . 0.0 111.72 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 96.85 -3.05 62.37 Favored Glycine 0 N--CA 1.444 -0.829 0 CA-C-O 118.26 -1.3 . . . . 0.0 112.178 173.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 53.6 m -60.67 103.95 0.3 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 119.053 1.427 . . . . 0.0 107.742 170.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -59.5 132.9 55.39 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 165.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.91 147.58 26.19 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 169.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.26 144.25 54.95 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 161.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 31.7 m -141.67 152.34 62.67 Favored Pre-proline 0 CA--C 1.536 0.426 0 C-N-CA 126.129 1.772 . . . . 0.0 106.776 170.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.08 117.29 4.62 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 121.192 1.261 . . . . 0.0 108.894 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -76.22 174.36 10.22 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 167.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.94 -42.37 72.21 Favored 'General case' 0 C--O 1.231 0.107 0 O-C-N 121.189 -0.944 . . . . 0.0 111.215 178.791 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -77.66 -7.23 56.13 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -176.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 94.9 mm-40 -79.24 -9.0 59.47 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 121.341 -0.849 . . . . 0.0 111.937 168.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.27 -23.7 17.8 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-O 118.741 -1.033 . . . . 0.0 113.179 171.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.02 76.7 21.73 Favored Pre-proline 0 CA--C 1.534 0.358 0 C-N-CA 124.632 1.173 . . . . 0.0 110.426 -168.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -63.87 128.21 21.43 Favored 'Trans proline' 0 N--CA 1.451 -1.009 0 C-N-CA 122.331 2.021 . . . . 0.0 110.27 175.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.5 mm -60.28 96.52 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 126.202 1.801 . . . . 0.0 109.805 166.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.9 p -108.55 122.34 46.86 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.35 1.06 . . . . 0.0 108.858 -177.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.499 HD12 ' HD1' ' A' ' 28' ' ' TRP . 1.9 tm? -109.28 140.5 42.86 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.72 1.608 . . . . 0.0 107.877 -177.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.2 m -139.61 122.78 16.91 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 176.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -92.7 136.49 33.18 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 105.434 -2.061 . . . . 0.0 105.434 156.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.7 t 174.55 -154.82 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 128.718 2.807 . . . . 0.0 106.044 178.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 78.3 p -123.84 42.49 3.22 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.94 1.296 . . . . 0.0 111.913 -172.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.86 -6.75 2.95 Favored 'General case' 0 CA--C 1.552 1.048 0 O-C-N 119.546 -1.971 . . . . 0.0 114.729 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 70.8 p -122.94 -1.41 8.85 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.583 1.553 . . . . 0.0 112.06 166.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 84.55 -7.18 74.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.372 1.463 . . . . 0.0 113.24 -173.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -89.68 170.33 10.54 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 120.005 1.903 . . . . 0.0 109.143 170.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -69.75 86.23 0.49 Allowed 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 160.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -133.5 141.33 47.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.849 1.66 . . . . 0.0 107.388 -171.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.7 151.37 23.46 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 172.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.23 132.03 22.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 162.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -158.76 164.92 33.87 Favored Glycine 0 C--N 1.33 0.195 0 O-C-N 121.141 -0.974 . . . . 0.0 110.924 -178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -95.5 120.52 35.89 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.353 -2.092 . . . . 0.0 105.353 172.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.4 t -83.12 -158.67 0.29 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.591 1.156 . . . . 0.0 108.378 166.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . 0.419 ' HA3' ' O ' ' A' ' 101' ' ' GLY . . . -72.36 -17.86 77.88 Favored Glycine 0 CA--C 1.526 0.748 0 O-C-N 121.082 -1.011 . . . . 0.0 114.597 -170.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 44.0 t -150.88 -41.32 0.12 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.221 0.609 . . . . 0.0 109.666 162.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -103.47 105.7 16.03 Favored 'General case' 0 C--N 1.345 0.404 0 CA-C-O 122.17 0.986 . . . . 0.0 108.855 -170.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.3 ppt_? -60.11 148.95 34.08 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.64 -1.164 . . . . 0.0 109.298 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 29.3 p90 -139.43 174.14 10.82 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 124.595 1.158 . . . . 0.0 109.104 -163.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -155.54 166.09 34.6 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 126.456 1.903 . . . . 0.0 108.736 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 162.62 166.05 20.72 Favored Glycine 0 CA--C 1.526 0.78 0 C-N-CA 124.52 1.057 . . . . 0.0 110.537 167.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 13.1 p -72.33 166.1 23.17 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 118.383 1.092 . . . . 0.0 111.306 -177.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.5 p90 -142.01 175.27 9.87 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 123.621 0.768 . . . . 0.0 110.955 171.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -148.37 126.78 12.31 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.518 1.927 . . . . 0.0 109.737 -178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.27 99.33 12.37 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 126.216 1.807 . . . . 0.0 106.399 168.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.26 165.14 32.79 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.563 1.145 . . . . 0.0 108.413 173.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 37.3 t70 60.34 6.24 1.0 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.595 1.958 . . . . 0.0 114.92 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 62.2 27.91 69.88 Favored Glycine 0 CA--C 1.529 0.914 0 O-C-N 120.119 -1.613 . . . . 0.0 111.696 -163.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.418 ' HB2' ' CG2' ' A' ' 118' ' ' THR . 25.6 pttt -121.28 171.02 9.03 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 125.119 1.368 . . . . 0.0 109.089 166.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 56.3 tp -98.92 134.92 41.09 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 164.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.86 134.78 48.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 119.589 1.086 . . . . 0.0 108.538 166.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -90.41 -176.2 4.71 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.374 0.67 . . . . 0.0 110.362 -178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -120.92 -149.29 8.16 Favored Glycine 0 CA--C 1.525 0.665 0 C-N-CA 126.292 1.901 . . . . 0.0 109.508 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 14.9 t -69.66 85.98 0.47 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 172.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.5 mt -77.35 135.77 38.39 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 125.674 1.59 . . . . 0.0 109.363 176.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -169.32 168.88 41.59 Favored Glycine 0 C--N 1.332 0.339 0 CA-C-O 121.638 0.577 . . . . 0.0 112.553 171.306 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -145.37 -168.83 13.25 Favored Glycine 0 CA--C 1.521 0.459 0 C-N-CA 125.1 1.333 . . . . 0.0 109.976 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 11.2 p -73.89 -179.05 3.5 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.54 1.136 . . . . 0.0 110.67 171.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 55.3 mtt180 -129.49 82.28 2.07 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 173.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.3 mtt -77.02 -175.87 3.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 167.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.84 110.69 16.2 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 124.081 0.953 . . . . 0.0 110.85 177.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 64.9 m -120.07 102.93 8.87 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 124.063 0.945 . . . . 0.0 108.552 164.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.45 57.16 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 128.643 2.777 . . . . 0.0 113.216 -178.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 41.1 p -149.32 155.29 39.51 Favored Pre-proline 0 C--O 1.239 0.51 0 O-C-N 120.935 -1.103 . . . . 0.0 110.129 -161.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -72.62 -29.57 12.93 Favored 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.573 2.182 . . . . 0.0 111.126 178.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.419 ' O ' ' HA3' ' A' ' 70' ' ' GLY . . . -76.11 -8.19 84.96 Favored Glycine 0 C--O 1.217 -0.945 0 CA-C-O 117.5 -1.722 . . . . 0.0 111.471 172.009 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.38 -59.12 2.07 Favored Glycine 0 CA--C 1.525 0.664 0 CA-C-N 120.769 2.284 . . . . 0.0 110.698 175.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -67.83 -12.26 60.25 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -165.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 13.7 tt -65.15 -16.9 20.94 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 C-N-CA 125.837 1.655 . . . . 0.0 113.335 175.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -45.38 -50.44 12.28 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 124.871 1.268 . . . . 0.0 111.319 -177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -56.52 -37.79 77.14 Favored Glycine 0 CA--C 1.528 0.861 0 CA-C-N 118.87 0.759 . . . . 0.0 112.179 -178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -73.28 -41.25 63.82 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 118.256 1.028 . . . . 0.0 110.161 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -55.12 -48.09 74.1 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 15.0 mt -65.31 -38.73 91.11 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.938 -178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.08 -19.7 64.88 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 113.346 0.869 . . . . 0.0 113.346 -177.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -92.54 -43.95 8.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 124.734 1.214 . . . . 0.0 111.041 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 39.1 mt -62.37 -18.14 60.78 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -175.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 2.9 p -72.63 -11.32 60.59 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.179 0.991 . . . . 0.0 113.066 174.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -124.45 56.39 1.28 Allowed 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 120.333 1.424 . . . . 0.0 110.859 -167.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.1 65.81 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 175.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.76 -31.61 59.61 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 121.193 -0.942 . . . . 0.0 109.997 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -124.19 162.81 22.86 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.004 1.321 . . . . 0.0 108.924 170.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.418 ' CG2' ' HB2' ' A' ' 84' ' ' LYS . 7.9 p -132.42 -163.7 1.37 Allowed 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 124.081 0.952 . . . . 0.0 111.232 -162.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 148.8 83.5 0.04 OUTLIER Glycine 0 C--O 1.225 -0.463 0 CA-C-N 113.816 -1.538 . . . . 0.0 110.998 156.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.529 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.2 p -97.86 151.0 4.47 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 119.109 1.454 . . . . 0.0 109.366 166.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.46 122.35 26.07 Favored 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 128.574 2.75 . . . . 0.0 104.474 -179.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 4.0 ttm -114.01 42.55 2.02 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.752 2.021 . . . . 0.0 110.404 -174.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -134.32 87.66 2.38 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.074 1.75 . . . . 0.0 107.973 -173.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -47.72 133.79 10.93 Favored Pre-proline 0 CA--C 1.537 0.464 0 C-N-CA 125.897 1.679 . . . . 0.0 112.782 -162.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.66 122.61 7.92 Favored 'Cis proline' 0 C--N 1.346 0.441 0 CA-C-O 121.988 0.745 . . . . 0.0 113.083 4.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -82.06 126.77 32.39 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.346 1.058 . . . . 0.0 108.454 -174.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -141.73 149.16 40.14 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 178.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 55.5 ttp -126.98 141.57 51.76 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 -170.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -112.82 150.06 32.19 Favored 'General case' 0 N--CA 1.439 -0.997 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 171.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.776 ' H ' HD12 ' A' ' 130' ' ' LEU 0.272 0.1 OUTLIER -127.21 153.07 46.55 Favored 'General case' 0 N--CA 1.442 -0.854 0 C-N-CA 127.036 2.134 . . . . 0.0 105.646 155.199 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 27.6 t -141.81 122.89 12.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 103.378 -2.823 . . . . 0.0 103.378 -176.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 48.5 mt -74.4 169.29 17.98 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 122.122 0.963 . . . . 0.0 110.181 -176.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 37.5 p-10 -52.07 -26.73 11.7 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.521 -1.218 . . . . 0.0 112.675 164.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -2.66 45.08 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.991 1.269 . . . . 0.0 112.734 178.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 94.28 16.06 45.2 Favored Glycine 0 CA--C 1.528 0.892 0 CA-C-N 119.343 0.974 . . . . 0.0 114.549 166.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.67 172.25 5.44 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 121.301 -1.117 . . . . 0.0 108.862 171.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 22.9 m -146.82 116.55 7.17 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 119.095 -2.253 . . . . 0.0 109.931 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.615 HD21 ' CG ' ' A' ' 33' ' ' TRP . 0.2 OUTLIER -105.16 161.16 14.5 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.646 1.178 . . . . 0.0 109.816 179.842 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 52.5 m -135.05 123.37 23.13 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 123.413 0.685 . . . . 0.0 110.195 -175.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -111.07 151.59 27.89 Favored 'General case' 0 N--CA 1.452 -0.343 0 O-C-N 124.066 0.854 . . . . 0.0 111.531 165.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -92.59 150.4 20.75 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 124.843 1.257 . . . . 0.0 108.672 153.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 12.4 tpt180 -68.7 144.16 54.51 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 165.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 38.3 t -132.01 85.9 2.29 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 169.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.2 m -79.57 25.76 0.32 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.721 1.208 . . . . 0.0 110.67 167.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 87.5 mtt180 . . . . . 0 C--O 1.247 0.952 0 C-N-CA 127.559 2.344 . . . . 0.0 110.571 -172.491 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 107.948 -1.13 . . . . 0.0 107.948 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -78.22 170.75 18.14 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 CA-C-N 121.176 1.456 . . . . 0.0 111.283 176.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.498 ' HD2' ' H ' ' A' ' 3' ' ' LYS . 0.0 OUTLIER -59.66 154.66 17.34 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.68 1.192 . . . . 0.0 110.513 177.769 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -108.76 166.12 11.41 Favored Pre-proline 0 CA--C 1.533 0.293 0 C-N-CA 126.238 1.815 . . . . 0.0 109.206 -177.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -69.6 65.7 1.69 Allowed 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.768 2.312 . . . . 0.0 110.424 164.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -81.17 177.49 8.99 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 126.144 1.777 . . . . 0.0 108.554 163.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 t -165.83 178.34 6.59 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 126.347 1.859 . . . . 0.0 107.773 172.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -85.46 15.78 4.25 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -125.12 82.51 2.07 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.019 0.928 . . . . 0.0 108.86 -178.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 15.5 t -136.75 163.64 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -178.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.57 163.57 52.91 Favored Pre-proline 0 CA--C 1.535 0.388 0 C-N-CA 124.23 1.012 . . . . 0.0 110.668 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -70.98 133.86 24.2 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.882 1.721 . . . . 0.0 108.371 162.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -76.4 165.29 53.93 Favored Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 126.709 2.004 . . . . 0.0 108.729 177.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.43 -165.95 0.25 Allowed 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 124.041 3.161 . . . . 0.0 111.125 175.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 65.08 84.06 0.16 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.484 1.913 . . . . 0.0 113.685 170.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -90.6 148.12 37.91 Favored Pre-proline 0 CA--C 1.536 0.434 0 O-C-N 120.764 -1.21 . . . . 0.0 112.624 175.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -65.0 -36.14 39.65 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 123.167 2.578 . . . . 0.0 110.498 169.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.7 21.56 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.87 2.068 . . . . 0.0 113.155 174.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -117.41 -18.58 9.8 Favored 'General case' 0 C--N 1.328 -0.332 0 O-C-N 120.177 -1.577 . . . . 0.0 111.722 169.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.3 m -72.24 -13.51 61.54 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.712 0.687 . . . . 0.0 111.89 -178.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -79.96 2.09 24.9 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 125.044 1.338 . . . . 0.0 114.289 -179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -107.38 2.65 24.53 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.016 0.927 . . . . 0.0 110.427 178.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.88 -3.44 25.71 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.215 1.406 . . . . 0.0 111.964 -175.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.07 -13.7 29.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 128.222 2.609 . . . . 0.0 113.531 178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -130.66 -17.62 3.22 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 126.379 1.871 . . . . 0.0 112.582 -169.301 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.2 p -71.23 172.31 9.52 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.343 1.057 . . . . 0.0 111.281 -169.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.49 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 70.2 m -143.24 -57.82 0.41 Allowed 'General case' 0 N--CA 1.443 -0.808 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.325 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.5 m95 63.75 173.59 0.17 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.689 1.596 . . . . 0.0 113.982 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 96.1 t -142.96 127.45 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 104.968 -2.234 . . . . 0.0 104.968 175.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.578 HD11 HD23 ' A' ' 138' ' ' LEU . 36.2 tp -70.76 138.13 50.21 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 177.568 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 23.3 t -144.3 -20.71 0.55 Allowed 'General case' 0 C--O 1.237 0.427 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -177.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -133.88 155.63 49.54 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 120.595 1.543 . . . . 0.0 109.369 162.301 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.5 t90 -136.25 96.47 3.38 Favored 'General case' 0 N--CA 1.437 -1.085 0 N-CA-C 104.695 -2.335 . . . . 0.0 104.695 171.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.9 ttpt -100.65 159.03 15.5 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 173.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -104.42 168.14 9.28 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 -174.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -53.15 -11.76 0.3 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.05 -3.33 12.62 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.63 1.104 . . . . 0.0 112.704 177.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 102.37 8.13 44.49 Favored Glycine 0 CA--C 1.522 0.492 0 CA-C-O 118.394 -1.226 . . . . 0.0 112.204 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 19.3 m -73.58 99.27 3.02 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.77 1.785 . . . . 0.0 109.025 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -63.67 110.92 2.18 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 163.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 6.9 mtt-85 -65.05 164.32 13.12 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 122.064 0.935 . . . . 0.0 108.936 169.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.63 144.04 28.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.049 165.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 33.3 m -146.17 163.05 32.43 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 127.038 2.135 . . . . 0.0 109.61 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -73.97 115.56 4.36 Favored 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 121.682 1.588 . . . . 0.0 109.825 170.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.69 172.77 10.83 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 122.957 0.503 . . . . 0.0 109.876 165.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.05 -44.67 79.06 Favored 'General case' 0 N--CA 1.462 0.168 0 O-C-N 121.61 -0.681 . . . . 0.0 109.943 172.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -65.38 -12.58 53.52 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -76.74 -5.07 46.57 Favored 'General case' 0 N--CA 1.466 0.343 0 O-C-N 120.579 -1.325 . . . . 0.0 113.095 173.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.72 -42.94 1.77 Allowed Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 123.446 0.546 . . . . 0.0 112.407 167.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.89 82.74 63.32 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 125.286 1.435 . . . . 0.0 108.642 177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -72.46 171.63 16.68 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 124.285 3.323 . . . . 0.0 111.452 173.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 12.9 mt -93.45 106.55 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 123.866 0.866 . . . . 0.0 109.594 176.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 1.5 p -81.59 162.46 23.12 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 166.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.21 163.71 26.11 Favored 'General case' 0 C--O 1.241 0.629 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 170.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -154.89 129.26 9.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 120.507 -1.371 . . . . 0.0 109.54 178.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -135.1 66.2 1.53 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.272 1.429 . . . . 0.0 110.511 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 t -124.55 -172.86 2.65 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 124.134 0.974 . . . . 0.0 109.352 -177.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.4 p -106.22 52.91 0.71 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 123.795 0.838 . . . . 0.0 110.31 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.5 t -67.22 -21.5 65.75 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.984 -1.073 . . . . 0.0 112.76 -175.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.7 p -96.4 1.59 51.86 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 120.404 1.456 . . . . 0.0 111.035 169.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.48 -1.04 10.11 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 126.146 1.831 . . . . 0.0 113.034 -167.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -99.47 172.34 7.38 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 119.889 1.844 . . . . 0.0 108.191 151.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -86.79 86.03 7.31 Favored 'General case' 0 C--O 1.241 0.629 0 C-N-CA 125.795 1.638 . . . . 0.0 107.078 -168.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -120.02 106.54 12.11 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 125.331 1.452 . . . . 0.0 111.358 -162.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.44 143.69 44.63 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.922 2.089 . . . . 0.0 108.847 172.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -150.91 176.71 10.84 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 125.499 1.52 . . . . 0.0 108.384 173.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 166.68 163.49 20.52 Favored Glycine 0 CA--C 1.52 0.386 0 N-CA-C 108.692 -1.763 . . . . 0.0 108.692 171.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 73.6 t80 -89.46 109.84 20.72 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 105.29 -2.115 . . . . 0.0 105.29 162.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.5 t -85.62 172.62 10.76 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.396 0.998 . . . . 0.0 108.569 165.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -44.66 -40.15 6.37 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 126.499 2.0 . . . . 0.0 116.225 -155.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 42.4 t -116.62 -29.5 6.09 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 122.171 -0.605 . . . . 0.0 112.048 169.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -131.32 125.0 31.61 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-O 122.346 1.07 . . . . 0.0 108.468 -164.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.1 OUTLIER -62.75 151.66 37.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.409 165.323 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 26.0 p90 -140.39 174.48 10.47 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 125.571 1.548 . . . . 0.0 109.131 -175.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.4 ptp -154.76 166.28 33.93 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 126.079 1.752 . . . . 0.0 109.684 178.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 167.0 -178.82 41.08 Favored Glycine 0 CA--C 1.531 1.068 0 C-N-CA 125.184 1.373 . . . . 0.0 111.151 172.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 33.6 p -108.86 120.09 41.48 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.951 -1.323 . . . . 0.0 110.963 -173.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 24.2 p90 -88.94 -173.37 4.06 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 -175.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -167.18 129.85 1.72 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.751 1.16 . . . . 0.0 109.723 166.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.0 139.28 34.63 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 118.621 0.646 . . . . 0.0 109.362 172.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 8.3 ptpt -168.94 157.72 8.22 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.409 1.884 . . . . 0.0 109.057 172.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 t70 51.72 41.35 28.98 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.776 1.63 . . . . 0.0 113.735 170.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 66.11 1.98 11.86 Favored Glycine 0 CA--C 1.523 0.54 0 O-C-N 120.145 -1.597 . . . . 0.0 114.09 -175.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -123.3 175.86 6.46 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 119.501 1.65 . . . . 0.0 110.731 -176.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 16.7 tp -114.82 124.79 52.64 Favored 'General case' 0 N--CA 1.441 -0.915 0 N-CA-C 103.753 -2.684 . . . . 0.0 103.753 -178.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 60.9 p -107.44 153.52 22.69 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 171.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -121.31 153.51 37.62 Favored 'General case' 0 C--N 1.322 -0.63 0 C-N-CA 125.486 1.515 . . . . 0.0 108.967 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -81.62 -175.43 50.27 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.064 0.84 . . . . 0.0 112.324 177.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.3 m -65.1 105.28 1.03 Allowed 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 105.74 -1.948 . . . . 0.0 105.74 163.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 69.0 mt -88.94 166.71 13.75 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.594 0.757 . . . . 0.0 109.477 -176.035 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 178.97 -176.48 48.0 Favored Glycine 0 N--CA 1.448 -0.533 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.076 163.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -164.06 -121.06 0.55 Allowed Glycine 0 CA--C 1.524 0.598 0 N-CA-C 110.235 -1.146 . . . . 0.0 110.235 -177.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 76.6 p -128.15 -174.32 3.18 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.936 1.294 . . . . 0.0 109.944 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 19.3 mmm180 -130.46 45.46 2.81 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.224 1.81 . . . . 0.0 110.133 -175.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.7 mtm -59.4 155.12 15.42 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.86 128.72 42.99 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-N 118.047 0.385 . . . . 0.0 111.053 -171.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.264 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 58.4 m -134.97 108.66 7.98 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 107.177 -1.416 . . . . 0.0 107.177 164.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 8.7 ptp -72.13 68.33 0.71 Allowed 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 161.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 48.1 p -139.6 153.1 70.02 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 125.621 1.568 . . . . 0.0 108.394 173.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -75.88 -29.39 6.94 Favored 'Trans proline' 0 N--CA 1.454 -0.847 0 C-N-CA 122.146 1.897 . . . . 0.0 110.561 174.507 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -72.9 -1.53 55.54 Favored Glycine 0 C--N 1.34 0.795 0 CA-C-O 118.019 -1.434 . . . . 0.0 112.664 166.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -86.21 -58.53 1.96 Allowed Glycine 0 C--N 1.336 0.552 0 CA-C-N 119.552 1.676 . . . . 0.0 109.526 174.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.64 -10.19 43.49 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -167.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 tt -68.58 -15.5 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 O-C-N 121.32 -0.863 . . . . 0.0 111.935 174.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -44.83 -56.79 4.21 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.651 1.58 . . . . 0.0 110.959 173.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -63.6 -38.31 96.07 Favored Glycine 0 CA--C 1.526 0.733 0 CA-C-O 119.522 -0.599 . . . . 0.0 112.045 -177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -67.93 -41.77 82.03 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 117.696 0.748 . . . . 0.0 110.57 -178.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -58.67 -51.7 68.81 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 124.231 1.013 . . . . 0.0 110.136 -176.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 58.6 mt -56.42 -42.61 78.3 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.23 -11.02 60.44 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 178.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -102.76 -23.64 13.78 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 125.23 1.412 . . . . 0.0 111.049 177.481 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.79 -26.88 64.49 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 120.025 1.284 . . . . 0.0 110.772 166.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 42.5 p -73.3 -1.31 17.47 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.17 -0.956 . . . . 0.0 111.896 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 26.8 m-70 -132.48 86.31 2.31 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.745 2.018 . . . . 0.0 106.854 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.9 mm -115.86 88.44 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 102.942 -2.984 . . . . 0.0 102.942 167.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -74.06 -42.11 60.7 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 118.469 -1.292 . . . . 0.0 108.796 169.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 -127.22 173.59 9.61 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.097 0.559 . . . . 0.0 110.98 -175.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 16.0 m -155.29 162.93 40.75 Favored 'General case' 0 N--CA 1.47 0.537 0 O-C-N 119.963 -1.71 . . . . 0.0 108.739 176.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -165.54 92.19 0.1 Allowed Glycine 0 CA--C 1.525 0.692 0 C-N-CA 125.267 1.413 . . . . 0.0 109.737 178.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 1.7 p -90.87 135.64 26.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 118.195 0.998 . . . . 0.0 109.345 171.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -106.59 99.0 8.6 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 106.432 -1.692 . . . . 0.0 106.432 168.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.45 13.23 1.28 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.961 1.304 . . . . 0.0 112.697 179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.81 132.12 54.44 Favored 'General case' 0 C--O 1.222 -0.361 0 C-N-CA 126.782 2.033 . . . . 0.0 107.806 -175.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -55.91 124.45 58.3 Favored Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.273 1.429 . . . . 0.0 110.155 176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -78.25 111.81 2.31 Favored 'Cis proline' 0 N--CA 1.457 -0.674 0 CA-C-N 120.364 1.166 . . . . 0.0 111.055 4.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 71.6 mt-30 -70.04 122.07 18.67 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 -171.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -136.89 162.19 33.93 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.6 ttp -124.13 136.45 54.22 Favored 'General case' 0 N--CA 1.438 -1.073 0 N-CA-C 105.029 -2.211 . . . . 0.0 105.029 175.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -122.6 132.25 54.2 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 175.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 58.6 mt -136.55 153.65 50.93 Favored 'General case' 0 CA--C 1.474 -1.951 0 CA-C-O 122.884 1.326 . . . . 0.0 109.133 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 30.8 m -147.2 161.29 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.399 -3.001 0 CA-C-N 110.324 -3.126 . . . . 0.0 107.594 -160.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 8.4 mp -109.17 -174.58 2.54 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 113.494 -1.684 . . . . 0.0 107.56 -172.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -58.73 -40.74 84.65 Favored 'General case' 0 C--N 1.321 -0.655 0 C-N-CA 124.355 1.062 . . . . 0.0 111.968 171.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -76.51 -20.63 56.73 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.495 0.589 . . . . 0.0 111.136 171.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 76.98 51.37 6.29 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 124.811 1.196 . . . . 0.0 112.826 -172.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -49.93 171.24 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 117.916 0.858 . . . . 0.0 109.704 149.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 52.4 m -150.21 92.37 1.87 Allowed 'General case' 0 C--N 1.328 -0.353 0 O-C-N 119.601 -1.937 . . . . 0.0 109.685 -163.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.578 HD23 HD11 ' A' ' 30' ' ' LEU . 3.6 mp -100.02 113.38 25.93 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 123.893 0.877 . . . . 0.0 109.878 -173.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 20.5 m -77.1 128.15 33.92 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.526 -1.287 . . . . 0.0 107.526 173.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 12.6 m-85 -124.38 132.23 53.53 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 164.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -84.21 137.72 33.34 Favored 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.211 1.404 . . . . 0.0 108.255 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.0 132.15 51.99 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.735 1.152 . . . . 0.0 108.016 173.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . 0.403 ' C ' ' H ' ' A' ' 145' ' ' ARG . 0.4 OUTLIER -141.38 68.98 1.33 Allowed 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 122.917 1.341 . . . . 0.0 107.917 170.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 52.3 m -87.31 38.82 0.84 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.759 1.624 . . . . 0.0 106.844 159.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.403 ' H ' ' C ' ' A' ' 143' ' ' SER . 47.2 mtt180 . . . . . 0 C--O 1.247 0.96 1 C-N-CA 132.508 4.323 . . . . 0.0 105.063 175.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.593 HG22 ' HE3' ' A' ' 3' ' ' LYS . 2.9 mp . . . . . 0 N--CA 1.471 0.609 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.12 160.61 39.56 Favored 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 121.681 1.587 . . . . 0.0 112.12 164.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.593 ' HE3' HG22 ' A' ' 1' ' ' ILE . 14.6 pttp 174.85 77.38 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.977 2.111 . . . . 0.0 110.846 175.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -114.19 152.62 46.06 Favored Pre-proline 0 C--O 1.235 0.323 0 C-N-CA 124.461 1.104 . . . . 0.0 108.573 165.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_endo -72.9 95.59 0.83 Allowed 'Trans proline' 0 N--CA 1.45 -1.035 0 C-N-CA 123.211 2.608 . . . . 0.0 108.023 169.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -159.44 165.64 32.7 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 129.787 3.235 . . . . 0.0 105.744 -179.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 t 63.44 158.15 0.07 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.519 1.928 . . . . 0.0 110.899 -159.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -145.68 65.73 1.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.646 1.578 . . . . 0.0 106.95 177.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -153.67 110.62 3.41 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 10.3 p -63.37 108.97 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 157.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.52 156.34 38.63 Favored Pre-proline 0 C--O 1.239 0.552 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 170.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -64.86 131.09 27.9 Favored 'Trans proline' 0 N--CA 1.448 -1.199 0 C-N-CA 122.212 1.941 . . . . 0.0 108.051 171.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -71.93 155.76 91.65 Favored Pre-proline 0 C--O 1.241 0.658 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.51 -179.05 1.74 Allowed 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.638 2.892 . . . . 0.0 111.593 175.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 69.63 164.57 0.26 Allowed 'General case' 0 C--O 1.235 0.295 0 C-N-CA 127.131 2.172 . . . . 0.0 111.403 -179.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -134.79 143.91 48.37 Favored Pre-proline 0 N--CA 1.435 -1.207 0 C-N-CA 124.805 1.242 . . . . 0.0 108.615 175.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -70.29 -23.75 28.01 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 122.385 2.057 . . . . 0.0 110.67 166.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.45 14.07 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.841 2.057 . . . . 0.0 113.812 173.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.588 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -123.65 -12.22 7.68 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 127.121 2.168 . . . . 0.0 112.286 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.499 HG21 ' C ' ' A' ' 84' ' ' LYS . 3.4 m -82.7 -16.21 48.99 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 119.151 0.887 . . . . 0.0 112.384 -174.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -76.08 -0.72 22.85 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 120.82 -1.175 . . . . 0.0 114.141 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.2 3.11 51.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.291 0.636 . . . . 0.0 110.773 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -77.48 32.78 0.16 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 126.678 1.991 . . . . 0.0 112.511 -171.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -94.07 -35.35 12.61 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 120.612 -1.305 . . . . 0.0 111.467 -178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -141.16 19.86 2.26 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 123.077 1.417 . . . . 0.0 109.868 -165.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 41.1 p -84.64 -170.58 3.19 Favored 'General case' 0 CA--C 1.542 0.665 0 O-C-N 120.887 -1.133 . . . . 0.0 108.268 167.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -152.37 -61.46 0.16 Allowed 'General case' 0 CA--C 1.506 -0.712 0 O-C-N 119.326 -2.109 . . . . 0.0 111.642 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.8 m95 65.9 159.46 0.12 Allowed 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 123.81 1.767 . . . . 0.0 115.23 176.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 22.3 t -135.22 125.05 43.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 C-N-CA 128.287 2.635 . . . . 0.0 107.845 174.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 42.6 tp -62.62 126.5 27.56 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 106.53 -1.656 . . . . 0.0 106.53 170.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -126.85 -19.51 4.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 118.887 0.767 . . . . 0.0 112.085 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -146.08 156.4 43.43 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.974 -1.079 . . . . 0.0 110.635 163.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 4.0 t90 -132.1 100.27 4.99 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.95 139.14 33.52 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -80.93 170.59 16.06 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.73 0.812 . . . . 0.0 109.953 166.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.69 -35.23 74.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.329 0.652 . . . . 0.0 112.341 178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -75.9 -12.31 60.13 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 121.601 -0.687 . . . . 0.0 111.824 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 100.98 14.02 32.39 Favored Glycine 0 N--CA 1.443 -0.888 0 CA-C-O 118.808 -0.995 . . . . 0.0 113.039 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -79.01 108.99 12.9 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.263 1.531 . . . . 0.0 109.095 176.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.05 114.58 5.31 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.406 -0.809 . . . . 0.0 109.102 164.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 24.1 mtt180 -64.61 163.64 13.34 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 124.677 1.191 . . . . 0.0 110.808 178.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.99 134.14 52.3 Favored 'General case' 0 CA--C 1.517 -0.302 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 155.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.6 m -132.01 159.7 70.97 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.563 -1.643 . . . . 0.0 106.563 166.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -78.64 114.24 3.43 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.744 1.63 . . . . 0.0 110.983 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.1 m -71.22 173.27 7.92 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.185 -0.947 . . . . 0.0 110.288 170.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.76 -35.58 66.37 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 121.471 -0.768 . . . . 0.0 111.758 176.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -73.15 -20.9 60.81 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.037 0.535 . . . . 0.0 112.347 -178.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -73.35 -14.56 61.31 Favored 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.619 -0.676 . . . . 0.0 112.006 176.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.74 -19.46 54.53 Favored Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 124.398 0.999 . . . . 0.0 114.397 167.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -131.53 71.09 81.48 Favored Pre-proline 0 N--CA 1.45 -0.447 0 C-N-CA 123.967 0.907 . . . . 0.0 109.738 171.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -63.21 156.95 52.37 Favored 'Trans proline' 0 N--CA 1.451 -1.021 0 C-N-CA 122.223 1.948 . . . . 0.0 110.057 172.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 5.7 mt -89.8 134.9 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 170.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.1 p -130.51 165.5 22.55 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 176.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -135.14 155.04 51.38 Favored 'General case' 0 C--O 1.242 0.677 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 175.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 4.2 m -151.73 115.15 4.8 Favored 'General case' 0 C--O 1.236 0.356 0 O-C-N 120.868 -1.145 . . . . 0.0 109.387 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -92.7 113.56 25.87 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 170.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -161.75 -174.42 4.19 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 176.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 64.6 p -134.29 27.82 3.77 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.533 1.133 . . . . 0.0 112.116 -171.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 63.8 m -44.93 -36.48 3.38 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 126.052 1.741 . . . . 0.0 114.286 172.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.9 t -72.96 -28.75 62.59 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.669 1.122 . . . . 0.0 111.143 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.01 -23.54 5.54 Favored Glycine 0 CA--C 1.529 0.955 0 C-N-CA 127.536 2.494 . . . . 0.0 111.962 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 11.2 mp0 -117.57 172.21 7.49 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.852 1.661 . . . . 0.0 109.57 177.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -61.57 93.46 0.04 OUTLIER 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.262 1.025 . . . . 0.0 110.552 167.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -131.06 120.63 23.7 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 126.546 1.938 . . . . 0.0 107.14 -176.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.94 30.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.985 177.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 51.2 p -152.79 174.25 14.28 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 159.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 163.89 -165.3 36.92 Favored Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 174.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -121.12 127.66 51.81 Favored 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.5 p -93.78 -7.15 44.31 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 125.246 1.418 . . . . 0.0 112.784 -175.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 143.67 -44.8 0.92 Allowed Glycine 0 C--N 1.336 0.556 0 CA-C-N 118.382 0.537 . . . . 0.0 112.005 -175.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 5.4 p -157.98 -32.03 0.07 Allowed 'General case' 0 CA--C 1.52 -0.201 0 O-C-N 120.86 -1.376 . . . . 0.0 111.717 173.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -97.63 -0.02 46.43 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -173.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . 0.278 0.8 OUTLIER 48.01 -174.66 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 127.471 2.308 . . . . 0.0 113.385 -175.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -154.53 164.97 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.498 178.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -158.28 173.73 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 128.493 2.717 . . . . 0.0 107.707 167.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 148.53 174.69 20.44 Favored Glycine 0 CA--C 1.528 0.861 0 C-N-CA 125.628 1.585 . . . . 0.0 110.146 170.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 70.5 p -71.93 169.18 16.4 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.714 0.769 . . . . 0.0 110.755 -175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -148.99 174.78 11.91 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.471 0.708 . . . . 0.0 109.334 167.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -155.94 148.62 23.98 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.871 1.268 . . . . 0.0 108.983 169.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.41 114.4 26.8 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -151.11 166.26 31.35 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 53.55 13.4 0.47 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.233 1.813 . . . . 0.0 115.463 174.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 73.43 17.34 78.92 Favored Glycine 0 CA--C 1.531 1.059 0 O-C-N 120.495 -1.378 . . . . 0.0 112.56 -170.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.499 ' C ' HG21 ' A' ' 20' ' ' THR . 10.9 pttt -131.33 179.24 6.14 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 127.195 2.198 . . . . 0.0 110.129 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.05 109.39 20.82 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 104.433 -2.432 . . . . 0.0 104.433 -179.245 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 57.6 p -97.45 152.82 18.58 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.019 0.827 . . . . 0.0 109.629 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -108.0 -164.81 0.99 Allowed 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 124.277 1.031 . . . . 0.0 110.266 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -130.9 -156.68 8.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 125.931 1.729 . . . . 0.0 111.595 -178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.4 t -74.71 71.03 1.91 Allowed 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 172.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 80.1 mt -66.36 155.06 38.42 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.54 1.136 . . . . 0.0 108.096 -178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.85 -175.88 43.62 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 169.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.15 -149.72 5.18 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-O 121.794 0.663 . . . . 0.0 111.558 -167.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 72.3 p -100.18 -172.14 2.16 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 124.227 1.011 . . . . 0.0 109.993 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 30.4 mmt180 -135.5 87.84 2.36 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 104.751 -2.314 . . . . 0.0 104.751 171.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 12.3 mtt -114.42 165.2 12.97 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.633 1.173 . . . . 0.0 110.075 173.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -69.57 150.43 47.1 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-O 122.774 1.273 . . . . 0.0 110.602 163.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -145.09 147.16 32.24 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 130.411 3.484 . . . . 0.0 106.637 163.8 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 21.6 ptp -129.09 28.6 5.27 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 125.953 1.701 . . . . 0.0 109.835 -177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 53.7 p -132.02 154.22 81.63 Favored Pre-proline 0 N--CA 1.446 -0.666 0 C-N-CA 125.953 1.701 . . . . 0.0 107.663 -168.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -66.15 -41.93 11.89 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 121.303 1.335 . . . . 0.0 109.348 176.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -62.51 -17.14 56.51 Favored Glycine 0 C--N 1.339 0.708 0 CA-C-O 118.003 -1.443 . . . . 0.0 113.268 176.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -67.86 -56.11 12.01 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 120.102 1.951 . . . . 0.0 110.869 167.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -73.94 -18.39 60.9 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 118.471 1.136 . . . . 0.0 113.047 -162.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 18.2 tt -66.77 -13.72 16.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 123.278 0.631 . . . . 0.0 111.403 172.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -50.06 -43.24 51.06 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 125.426 1.49 . . . . 0.0 111.439 173.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.71 -42.6 98.01 Favored Glycine 0 CA--C 1.522 0.517 0 CA-C-O 119.417 -0.657 . . . . 0.0 111.611 179.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.61 69.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.632 0.716 . . . . 0.0 109.638 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 55.6 t80 -62.72 -54.48 38.61 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.993 0.917 . . . . 0.0 110.477 -175.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -53.48 -50.05 66.18 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 174.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -55.28 -48.31 74.23 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.89 0.314 . . . . 0.0 111.225 -178.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.01 64.43 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.232 1.013 . . . . 0.0 112.88 -173.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.08 -14.72 61.45 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.782 1.174 . . . . 0.0 112.293 173.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 26.4 p -84.46 4.39 31.89 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 119.287 0.949 . . . . 0.0 111.368 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -133.38 80.88 1.9 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 127.43 2.292 . . . . 0.0 108.659 -171.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -118.03 51.67 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 CA-C-N 119.331 0.969 . . . . 0.0 109.959 176.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -61.95 -32.58 73.02 Favored 'General case' 0 N--CA 1.466 0.366 0 O-C-N 120.973 -1.079 . . . . 0.0 111.622 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 6.6 mtp180 -128.32 168.09 16.02 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.182 1.393 . . . . 0.0 109.789 -175.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 t -162.97 -179.01 6.44 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 121.081 -1.012 . . . . 0.0 110.598 -164.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 172.3 69.79 0.04 OUTLIER Glycine 0 CA--C 1.534 1.221 0 CA-C-N 118.993 0.815 . . . . 0.0 114.279 -176.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.588 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.0 p -85.15 142.05 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-N 120.797 2.298 . . . . 0.0 109.078 171.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -105.76 96.2 6.33 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 106.873 -1.529 . . . . 0.0 106.873 166.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.565 ' HB2' ' HB1' ' A' ' 19' ' ' ALA . 32.2 tpp -81.96 60.62 4.88 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 171.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.26 110.14 2.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -48.23 132.34 12.69 Favored Pre-proline 0 CA--C 1.542 0.652 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.893 178.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -72.57 119.82 5.5 Favored 'Cis proline' 0 C--N 1.347 0.493 0 CA-C-N 119.543 0.872 . . . . 0.0 111.3 -0.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -78.07 136.69 37.95 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -175.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -140.91 165.87 26.34 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 127.82 2.448 . . . . 0.0 105.605 171.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 27.7 ttp -131.29 128.88 40.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 174.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -112.62 146.39 38.7 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 169.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 37.5 mt -135.11 139.99 45.12 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 104.305 -2.48 . . . . 0.0 104.305 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 73.9 t -129.07 126.24 64.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 N-CA-C 106.605 -1.628 . . . . 0.0 106.605 -168.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 9.9 mp -73.95 165.92 24.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 122.666 1.222 . . . . 0.0 108.733 176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -58.01 -36.12 72.22 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 124.724 1.21 . . . . 0.0 109.892 167.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -72.04 -19.86 61.77 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 125.895 1.678 . . . . 0.0 110.498 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 93.44 12.54 57.06 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-O 118.307 -1.274 . . . . 0.0 114.388 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -60.33 145.59 47.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 120.09 1.945 . . . . 0.0 107.423 164.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 15.1 m -125.12 96.6 4.91 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 124.947 1.299 . . . . 0.0 109.163 -177.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 4.1 mp -81.54 127.58 33.0 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 121.072 -1.018 . . . . 0.0 108.333 177.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 36.7 m -113.95 118.52 34.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.391 1.877 . . . . 0.0 107.644 -175.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -114.74 150.58 35.12 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.148 1.379 . . . . 0.0 108.785 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -92.13 149.3 21.57 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 124.279 1.031 . . . . 0.0 108.986 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 5.0 tpt85 -71.48 107.11 4.23 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 163.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -105.68 89.03 2.97 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 170.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.6 t -115.57 50.34 1.01 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 122.038 0.923 . . . . 0.0 108.91 -178.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 13.5 mtm180 . . . . . 0 C--O 1.251 1.17 0 CA-C-O 117.019 -1.467 . . . . 0.0 107.778 -179.213 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 13.1 pt . . . . . 0 N--CA 1.468 0.444 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.59 -173.35 0.68 Allowed 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 123.796 2.998 . . . . 0.0 111.238 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.94 169.4 0.23 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.9 1.28 . . . . 0.0 113.015 179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -123.43 165.31 23.4 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 127.385 2.274 . . . . 0.0 108.655 177.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.48 82.46 2.39 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.946 2.43 . . . . 0.0 109.914 175.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -142.1 -169.51 2.95 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.912 1.685 . . . . 0.0 109.373 173.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 50.8 m -44.85 110.66 0.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.616 2.366 . . . . 0.0 114.753 -176.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -77.46 62.64 2.47 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.774 1.23 . . . . 0.0 107.7 159.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -136.14 34.33 2.82 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.306 1.042 . . . . 0.0 112.289 176.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -137.7 140.65 40.87 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 C-N-CA 124.702 1.201 . . . . 0.0 110.003 -178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -52.09 150.45 8.08 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 125.035 1.334 . . . . 0.0 110.784 175.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -72.24 131.46 17.87 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.496 2.131 . . . . 0.0 111.704 -168.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -71.52 144.53 89.0 Favored Pre-proline 0 C--O 1.238 0.477 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 171.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.32 -164.56 0.12 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.399 3.399 . . . . 0.0 112.256 177.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 70.8 35.17 1.83 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 126.077 1.751 . . . . 0.0 111.585 -177.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.07 144.71 58.2 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.215 1.406 . . . . 0.0 111.175 178.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -79.18 -26.15 5.36 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.634 2.89 . . . . 0.0 111.474 179.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.69 30.32 0.07 Allowed 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.114 1.365 . . . . 0.0 112.538 -178.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.405 ' HB1' ' SD ' ' A' ' 122' ' ' MET . . . -120.71 -11.06 9.08 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 128.303 2.641 . . . . 0.0 110.558 173.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -59.63 -39.17 83.45 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.122 0.969 . . . . 0.0 112.389 -169.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -63.78 -28.16 69.68 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 120.675 -1.265 . . . . 0.0 113.072 177.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.3 mp -81.86 34.68 0.4 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.947 1.699 . . . . 0.0 110.108 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 94.7 mt -107.35 -6.45 17.16 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.461 1.105 . . . . 0.0 110.898 174.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -60.77 -27.81 68.26 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 126.294 1.837 . . . . 0.0 114.901 -166.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -102.14 -14.09 17.2 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.621 1.568 . . . . 0.0 113.083 -177.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 46.2 p -89.43 174.88 7.55 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.756 -149.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 3.9 p -124.12 -73.96 0.63 Allowed 'General case' 0 CA--C 1.503 -0.84 0 O-C-N 121.13 -0.981 . . . . 0.0 112.388 -171.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 6.6 m95 69.82 162.68 0.23 Allowed 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 126.584 1.954 . . . . 0.0 111.421 -176.143 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 42.6 t -144.3 135.3 21.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 177.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -75.23 131.85 40.67 Favored 'General case' 0 C--O 1.239 0.541 0 N-CA-C 107.705 -1.22 . . . . 0.0 107.705 175.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.9 t -116.96 -26.17 6.97 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.474 -1.251 . . . . 0.0 113.626 172.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -153.87 146.38 24.07 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 121.325 1.875 . . . . 0.0 112.458 -177.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.698 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.7 t90 -137.98 101.63 4.48 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 127.808 2.443 . . . . 0.0 107.36 -176.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tppt? -84.8 131.87 34.49 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 169.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -69.82 167.12 17.94 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 163.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -58.28 -29.72 66.05 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 124.114 0.884 . . . . 0.0 112.459 -171.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -90.29 -16.83 28.52 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 118.757 0.708 . . . . 0.0 112.582 -177.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 121.2 -1.81 11.56 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.703 1.144 . . . . 0.0 113.4 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 m -64.33 93.73 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.667 1.734 . . . . 0.0 109.096 175.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.4 107.22 0.63 Allowed 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.677 -1.264 . . . . 0.0 109.719 169.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.45 142.75 57.73 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.776 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.63 130.94 41.06 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 25.7 m -128.77 153.88 79.87 Favored Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 106.462 -1.681 . . . . 0.0 106.462 174.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -70.1 113.32 3.39 Favored 'Trans proline' 0 N--CA 1.449 -1.103 0 C-N-CA 121.129 1.219 . . . . 0.0 110.26 -177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -62.14 169.15 2.88 Favored 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 123.338 0.655 . . . . 0.0 110.664 166.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.58 -21.35 62.53 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.978 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -102.01 -9.26 20.77 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 83.7 mm-40 -68.81 -15.26 63.45 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 118.268 -0.872 . . . . 0.0 112.024 173.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.67 -79.57 0.28 Allowed Glycine 0 C--N 1.336 0.551 0 N-CA-C 109.658 -1.377 . . . . 0.0 109.658 176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.26 86.18 58.58 Favored Pre-proline 0 C--O 1.237 0.446 0 C-N-CA 128.211 2.604 . . . . 0.0 108.13 -168.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -66.85 160.21 47.89 Favored 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.443 2.096 . . . . 0.0 111.594 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.413 HG21 ' CE1' ' A' ' 108' ' ' TYR . 26.6 mt -75.17 103.56 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 176.257 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 p -103.29 157.81 16.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.599 0.759 . . . . 0.0 109.644 178.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 39.7 tp -127.21 157.92 38.51 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.516 1.127 . . . . 0.0 109.223 169.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 0.2 OUTLIER -141.7 128.15 20.06 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.547 1.539 . . . . 0.0 108.328 163.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -96.98 121.13 38.53 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 126.457 1.903 . . . . 0.0 106.159 161.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 23.0 t -151.57 -167.72 2.88 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.288 -1.005 . . . . 0.0 108.288 173.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.1 p -131.26 21.82 4.81 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.755 1.622 . . . . 0.0 111.277 -171.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.3 t -63.28 -29.76 71.03 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.226 1.41 . . . . 0.0 113.819 -165.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.5 t -78.99 -10.73 59.92 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.098 -1.001 . . . . 0.0 111.346 175.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 100.16 -6.35 58.07 Favored Glycine 0 CA--C 1.527 0.803 0 C-N-CA 125.803 1.668 . . . . 0.0 111.667 -169.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -132.3 166.93 20.8 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.533 1.533 . . . . 0.0 110.215 -176.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.2 ptp85 -66.04 74.67 0.08 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.815 2.046 . . . . 0.0 111.944 173.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.25 140.9 36.78 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 171.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -114.39 148.11 38.18 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.047 -1.464 . . . . 0.0 107.047 170.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.3 p -152.3 166.75 30.83 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 174.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 179.58 -169.4 40.4 Favored Glycine 0 C--N 1.331 0.29 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -176.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -106.26 132.96 51.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 169.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.2 m -114.52 22.88 13.24 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 126.475 1.91 . . . . 0.0 110.836 174.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 131.56 -73.5 0.46 Allowed Glycine 0 CA--C 1.527 0.803 0 CA-C-O 117.287 -1.84 . . . . 0.0 112.08 178.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.6 OUTLIER -144.51 -4.92 0.76 Allowed 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 121.579 2.69 . . . . 0.0 113.878 179.591 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.433 ' H ' ' CD ' ' A' ' 105' ' ' GLU . 16.3 m120 -115.97 -6.27 11.99 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.226 1.411 . . . . 0.0 114.268 -172.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 4.3 mtm180 61.98 174.86 0.13 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 131.493 3.917 . . . . 0.0 111.74 -179.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 7.1 p90 -147.68 161.2 41.65 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 121.369 0.604 . . . . 0.0 111.719 170.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -156.8 164.83 37.65 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.576 2.351 . . . . 0.0 108.266 173.208 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.07 173.98 27.18 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 174.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 24.0 p -89.33 160.64 16.77 Favored 'General case' 0 CA--C 1.519 -0.214 0 O-C-N 122.123 -0.633 . . . . 0.0 109.755 -177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 15.2 p90 -140.26 -174.62 3.99 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.756 -0.59 . . . . 0.0 111.75 179.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -153.19 165.76 34.67 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.627 1.571 . . . . 0.0 108.542 166.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 79.5 mt -128.88 105.43 8.22 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.7 ptmt -163.08 170.34 18.08 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 126.181 1.792 . . . . 0.0 108.65 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 57.62 21.7 7.48 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.061 1.344 . . . . 0.0 112.966 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.36 19.88 64.8 Favored Glycine 0 CA--C 1.528 0.897 0 CA-C-O 118.467 -1.185 . . . . 0.0 112.653 -171.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 11.8 pttt -139.78 178.74 7.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.397 1.599 . . . . 0.0 111.19 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 3.5 tt -115.41 113.37 23.66 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 178.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.14 134.09 36.95 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 170.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -88.69 -172.78 3.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.08 -149.01 7.91 Favored Glycine 0 CA--C 1.523 0.558 0 C-N-CA 126.664 2.078 . . . . 0.0 109.641 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.0 t -61.56 110.34 1.45 Allowed 'General case' 0 C--O 1.237 0.423 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 162.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.6 mt -88.21 169.62 11.72 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 125.333 1.453 . . . . 0.0 109.4 171.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 177.55 177.59 46.51 Favored Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 110.791 -0.924 . . . . 0.0 110.791 158.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -157.1 -173.68 25.84 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 70.1 p -71.4 179.45 2.94 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.889 0.876 . . . . 0.0 111.425 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -131.49 47.65 2.51 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 125.183 1.393 . . . . 0.0 108.297 172.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 73.7 mtm -63.1 157.08 23.15 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 166.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -112.1 129.82 56.1 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.52 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 96.9 m -136.71 125.74 24.4 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 126.883 2.073 . . . . 0.0 108.319 -169.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 3.5 mtp -90.73 53.06 2.31 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.994 0.902 . . . . 0.0 109.795 -174.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 72.7 p -134.55 153.29 78.99 Favored Pre-proline 0 C--O 1.239 0.507 0 C-N-CA 124.394 1.077 . . . . 0.0 108.25 -170.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -72.63 -37.77 3.78 Favored 'Trans proline' 0 N--CA 1.452 -0.95 0 C-N-CA 121.257 1.305 . . . . 0.0 108.883 177.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -77.07 15.64 6.36 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-O 118.056 -1.413 . . . . 0.0 111.933 172.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -113.19 -11.0 14.3 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-N 120.504 2.152 . . . . 0.0 111.855 163.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -88.39 -21.06 24.5 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 169.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.4 tt -71.16 -14.1 17.59 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 120.093 1.315 . . . . 0.0 113.179 -169.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -57.34 -41.44 80.03 Favored 'General case' 0 C--N 1.332 -0.167 0 O-C-N 121.004 -1.06 . . . . 0.0 112.516 -172.346 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -57.12 -47.44 87.57 Favored Glycine 0 CA--C 1.523 0.578 0 C-N-CA 124.346 0.974 . . . . 0.0 111.249 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.39 -51.42 67.62 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 117.755 0.778 . . . . 0.0 109.678 177.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.413 ' CE1' HG21 ' A' ' 52' ' ' ILE . 52.1 t80 -64.5 -40.57 95.9 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.487 0.315 . . . . 0.0 111.359 -170.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 7.3 mp -61.5 -37.19 82.78 Favored 'General case' 0 N--CA 1.464 0.238 0 O-C-N 121.256 -0.903 . . . . 0.0 110.467 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.98 -21.16 65.07 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 113.222 0.823 . . . . 0.0 113.222 174.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -83.36 -39.74 20.32 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 121.322 -0.861 . . . . 0.0 109.479 178.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 96.1 mt -63.0 -13.5 35.99 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.134 0.974 . . . . 0.0 113.141 176.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 46.9 p -97.84 8.89 43.96 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.01 1.324 . . . . 0.0 110.838 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 -134.96 65.21 1.57 Allowed 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 109.637 178.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -100.85 79.37 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 169.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -68.83 -36.52 78.3 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 118.699 -1.2 . . . . 0.0 110.211 170.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.588 ' HG2' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -130.69 161.27 32.02 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.444 1.098 . . . . 0.0 110.966 -174.701 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.6 m -149.25 169.74 20.06 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.421 -1.326 . . . . 0.0 107.421 158.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -159.71 162.16 32.79 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 108.09 -2.004 . . . . 0.0 108.09 153.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 45.0 t -124.74 145.04 32.64 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.691 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -175.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -110.08 93.3 4.43 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 170.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.405 ' SD ' ' HB1' ' A' ' 19' ' ' ALA . 18.2 mtp -80.2 35.2 0.32 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.442 1.097 . . . . 0.0 111.495 176.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -132.12 124.71 29.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 105.849 -1.908 . . . . 0.0 105.849 -178.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -58.62 148.83 65.17 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 123.973 0.909 . . . . 0.0 110.573 -173.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.9 122.39 5.6 Favored 'Cis proline' 0 N--CA 1.455 -0.751 0 N-CA-C 108.895 -1.233 . . . . 0.0 108.895 -14.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -71.52 135.24 46.99 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.11 0.481 . . . . 0.0 110.705 -168.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -139.26 168.81 18.99 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 124.799 1.24 . . . . 0.0 109.282 174.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 11.7 tmm? -132.2 143.63 50.08 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.666 1.986 . . . . 0.0 106.843 178.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -138.01 139.39 39.61 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.883 0.849 . . . . 0.0 110.333 -174.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.79 ' H ' HD12 ' A' ' 130' ' ' LEU 0.266 0.0 OUTLIER -134.09 161.12 35.75 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 127.675 2.39 . . . . 0.0 109.516 176.881 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.588 ' HB ' ' HG2' ' A' ' 117' ' ' ARG . 25.2 t -133.54 136.55 54.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 103.642 -2.725 . . . . 0.0 103.642 172.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 1.4 mp -82.71 162.1 21.89 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 172.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 36.5 t0 -66.11 -26.57 67.52 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.483 0.659 . . . . 0.0 111.731 -173.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -81.36 -5.92 58.36 Favored 'General case' 0 C--O 1.234 0.247 0 C-N-CA 125.615 1.566 . . . . 0.0 111.619 176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 103.22 4.41 47.38 Favored Glycine 0 CA--C 1.529 0.929 0 CA-C-O 117.997 -1.446 . . . . 0.0 115.441 169.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -62.07 158.46 16.57 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 119.589 1.695 . . . . 0.0 109.25 172.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 10.0 m -128.54 115.25 17.83 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.806 1.242 . . . . 0.0 109.981 -176.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.698 HD21 ' CD1' ' A' ' 33' ' ' TRP . 1.2 mm? -116.03 152.23 33.96 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 121.722 -0.611 . . . . 0.0 109.61 -177.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 98.1 m -145.49 119.79 9.58 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.567 -164.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.571 ' CE1' HD11 ' A' ' 130' ' ' LEU . 78.0 m-85 -113.82 140.25 48.47 Favored 'General case' 0 CA--C 1.518 -0.287 0 C-N-CA 123.518 0.727 . . . . 0.0 110.28 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -93.4 136.11 33.98 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 125.415 1.486 . . . . 0.0 107.708 173.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -60.91 136.93 58.23 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 117.803 -1.094 . . . . 0.0 108.21 174.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 8.0 t -138.42 35.91 2.27 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-N 119.661 1.118 . . . . 0.0 111.189 172.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.9 m -76.75 25.21 0.14 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.943 1.297 . . . . 0.0 109.822 176.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.7 ttt180 . . . . . 0 C--O 1.254 1.336 0 C-N-CA 127.85 2.46 . . . . 0.0 111.736 171.552 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 23.6 pt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 110.573 -0.158 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -72.81 169.36 22.23 Favored 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 122.311 2.008 . . . . 0.0 110.502 172.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.0 ttmt -127.18 -29.78 2.72 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 124.717 1.207 . . . . 0.0 110.101 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -137.37 165.85 31.24 Favored Pre-proline 0 CA--C 1.534 0.357 0 C-N-CA 128.307 2.643 . . . . 0.0 107.634 171.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -62.73 -22.24 73.74 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.465 1.443 . . . . 0.0 113.103 178.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 35.2 t0 75.12 65.59 0.07 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 128.494 2.718 . . . . 0.0 109.184 -177.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 73.4 m -157.14 169.03 25.72 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.542 1.537 . . . . 0.0 110.465 178.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.47 58.52 4.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 127.242 2.217 . . . . 0.0 108.799 179.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.71 40.41 1.08 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.551 -0.749 . . . . 0.0 112.204 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 9.8 p -148.28 151.3 13.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.12 155.76 91.39 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 123.527 0.731 . . . . 0.0 110.541 173.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.04 129.93 20.51 Favored 'Trans proline' 0 N--CA 1.455 -0.747 0 C-N-CA 122.677 2.251 . . . . 0.0 110.91 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -67.68 144.33 97.46 Favored Pre-proline 0 C--O 1.241 0.627 0 C-N-CA 125.07 1.348 . . . . 0.0 109.975 -175.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.94 179.59 4.22 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.15 2.567 . . . . 0.0 112.042 -172.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 64.86 64.76 0.64 Allowed 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 125.386 1.474 . . . . 0.0 109.641 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -112.0 144.14 30.13 Favored Pre-proline 0 N--CA 1.465 0.32 0 CA-C-O 118.106 -0.95 . . . . 0.0 110.749 -170.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -73.46 -26.42 14.22 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 124.049 3.166 . . . . 0.0 111.902 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.77 49.82 0.24 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.584 171.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -156.16 -43.57 0.08 Allowed 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 127.919 2.487 . . . . 0.0 108.26 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 1.5 m -60.8 -16.9 45.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.994 2.517 . . . . 0.0 114.206 -164.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.9 pt20 -74.44 -24.05 59.01 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.943 1.697 . . . . 0.0 113.466 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.4 mp -72.42 -4.42 30.08 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.467 1.507 . . . . 0.0 111.155 -175.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.36 38.98 0.57 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.875 1.27 . . . . 0.0 111.278 -160.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -83.77 -51.54 7.14 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 123.692 0.797 . . . . 0.0 110.756 175.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -102.07 -3.09 28.16 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.211 1.004 . . . . 0.0 112.232 -158.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.61 167.24 11.6 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 123.059 1.409 . . . . 0.0 111.584 -156.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 60.9 p -141.72 155.69 45.64 Favored 'General case' 0 CA--C 1.496 -1.122 0 O-C-N 120.07 -1.644 . . . . 0.0 106.822 -175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.723 ' CD1' HD13 ' A' ' 54' ' ' LEU . 9.1 m95 -145.62 169.07 19.16 Favored 'General case' 0 N--CA 1.426 -1.641 0 CA-C-N 113.05 -1.886 . . . . 0.0 107.433 -175.142 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 77.0 t -136.02 124.03 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 169.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HB3' ' HB ' ' A' ' 52' ' ' ILE . 2.0 tm? -79.98 129.82 34.79 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.81 -7.78 3.57 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -154.91 141.7 19.05 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-N 119.666 1.121 . . . . 0.0 111.389 173.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.605 ' HB2' ' CD1' ' A' ' 138' ' ' LEU . 2.2 t90 -127.47 118.81 24.74 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 128.562 2.745 . . . . 0.0 106.19 174.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -98.71 130.75 45.21 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 170.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -66.28 168.26 9.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 118.359 0.527 . . . . 0.0 109.793 163.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.03 -33.13 71.61 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.479 1.111 . . . . 0.0 112.14 -174.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -23.57 63.91 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 120.811 0.339 . . . . 0.0 110.733 -177.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 110.33 3.14 29.4 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 126.663 2.078 . . . . 0.0 112.248 -169.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 52.6 m -67.85 104.05 1.6 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.049 1.424 . . . . 0.0 108.807 177.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.14 115.92 4.15 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 168.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 20.1 mtt180 -70.44 168.87 15.21 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.082 0.553 . . . . 0.0 109.623 172.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.75 152.3 27.06 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 151.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.42 ' HB ' ' HD2' ' A' ' 44' ' ' PRO . 23.4 m -140.36 165.65 28.79 Favored Pre-proline 0 C--O 1.238 0.489 0 C-N-CA 125.983 1.713 . . . . 0.0 108.492 170.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.42 ' HD2' ' HB ' ' A' ' 43' ' ' VAL . 19.5 Cg_endo -66.46 105.77 0.94 Allowed 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 123.005 2.47 . . . . 0.0 110.454 169.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.444 ' H ' ' HG3' ' A' ' 48' ' ' GLN . 0.7 OUTLIER -73.18 174.87 7.37 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 124.563 1.145 . . . . 0.0 111.352 167.798 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.76 -49.33 76.93 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 122.932 0.493 . . . . 0.0 112.241 178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -90.24 3.96 52.01 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.444 ' HG3' ' H ' ' A' ' 45' ' ' SER . 27.3 mm-40 -70.22 -24.99 63.19 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.328 -0.857 . . . . 0.0 110.641 171.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.66 -44.38 0.72 Allowed Glycine 0 C--N 1.342 0.862 0 C-N-CA 124.306 0.955 . . . . 0.0 112.533 173.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -150.29 85.44 5.41 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 127.198 2.199 . . . . 0.0 109.953 -165.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -69.53 138.6 38.94 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 123.176 2.584 . . . . 0.0 112.807 178.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.406 ' HB ' ' HB3' ' A' ' 30' ' ' LEU . 3.4 mt -62.95 119.43 6.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.927 0.891 . . . . 0.0 109.61 163.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 42.8 p -124.37 119.28 28.79 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 107.002 -1.481 . . . . 0.0 107.002 172.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.723 HD13 ' CD1' ' A' ' 28' ' ' TRP . 0.9 OUTLIER -72.35 144.23 48.34 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 124.911 1.284 . . . . 0.0 108.608 173.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 15.9 m -148.77 103.02 3.34 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 166.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.502 HD22 HD22 ' A' ' 54' ' ' LEU . 1.6 mm? -82.26 126.81 32.54 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 162.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.7 t -170.25 -159.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 105.719 -1.956 . . . . 0.0 105.719 176.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.2 p -118.89 51.2 1.13 Allowed 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 123.932 0.893 . . . . 0.0 112.231 171.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 33.1 t -57.88 -39.5 77.99 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.395 1.078 . . . . 0.0 112.526 -176.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.51 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 3.6 t -81.33 -10.93 59.46 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.571 0.748 . . . . 0.0 112.361 174.001 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.09 -12.25 40.77 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 125.177 1.37 . . . . 0.0 112.87 -173.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -120.87 162.32 20.02 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.591 1.695 . . . . 0.0 110.168 170.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.4 ptp85 -63.06 94.97 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.553 0.741 . . . . 0.0 110.861 176.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.51 ' CE1' ' HB ' ' A' ' 60' ' ' THR . 0.1 OUTLIER -138.7 154.41 48.58 Favored 'General case' 0 N--CA 1.432 -1.366 0 CA-C-O 122.144 0.973 . . . . 0.0 109.284 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.96 92.86 9.18 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 -169.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 28.2 p -98.09 66.49 1.83 Allowed 'General case' 0 N--CA 1.449 -0.525 0 CA-C-O 122.257 1.027 . . . . 0.0 109.84 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.06 161.29 26.63 Favored Glycine 0 CA--C 1.521 0.457 0 N-CA-C 110.281 -1.128 . . . . 0.0 110.281 178.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 29.4 t80 -88.0 119.41 28.34 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 104.388 -2.449 . . . . 0.0 104.388 157.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 22.7 t -83.92 176.57 8.79 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 160.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -73.77 11.16 6.1 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.958 1.266 . . . . 0.0 115.374 -155.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -159.38 3.29 0.09 Allowed 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 141.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -135.84 125.69 25.73 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 106.135 -1.802 . . . . 0.0 106.135 -172.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.549 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -69.5 139.61 53.88 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 121.772 -0.58 . . . . 0.0 110.03 168.599 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -112.74 169.04 9.18 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 126.236 1.814 . . . . 0.0 108.86 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.7 ptp -157.5 146.47 19.73 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 126.054 1.742 . . . . 0.0 107.516 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.56 156.33 7.97 Favored Glycine 0 CA--C 1.528 0.857 0 N-CA-C 111.571 -0.612 . . . . 0.0 111.571 168.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.8 m -94.83 120.5 35.15 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 122.613 0.365 . . . . 0.0 111.969 -146.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.501 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 41.3 p90 -98.0 171.09 8.49 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 121.195 0.522 . . . . 0.0 112.175 -169.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.51 145.67 25.35 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 126.738 2.015 . . . . 0.0 107.993 178.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -117.73 117.43 29.32 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 170.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -159.23 3.12 0.09 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 -173.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 48.0 m-20 -137.82 9.65 2.84 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.088 0.955 . . . . 0.0 113.454 -161.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.97 11.4 50.93 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 120.252 -1.53 . . . . 0.0 112.01 -157.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 31.6 pttt -137.87 165.94 25.25 Favored 'General case' 0 C--O 1.24 0.602 0 C-N-CA 126.93 2.092 . . . . 0.0 109.49 169.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.2 tt -75.08 146.52 41.4 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 128.362 2.665 . . . . 0.0 107.375 163.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.4 m -127.47 138.14 52.87 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 153.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -85.48 164.12 18.03 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -90.14 -171.65 44.45 Favored Glycine 0 CA--C 1.521 0.437 0 N-CA-C 108.108 -1.997 . . . . 0.0 108.108 165.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 m -58.37 106.53 0.39 Allowed 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.232 -1.396 . . . . 0.0 107.232 165.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 31.4 mt -82.81 156.37 23.69 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -154.2 167.01 32.27 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 165.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.09 179.46 21.39 Favored Glycine 0 N--CA 1.452 -0.277 0 CA-C-N 117.613 0.707 . . . . 0.0 111.901 -174.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.0 p -67.18 172.13 5.01 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 172.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.4 mtt-85 -120.52 77.34 1.26 Allowed 'General case' 0 CA--C 1.517 -0.295 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 169.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 30.5 mtt -76.86 158.78 30.55 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 175.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -98.11 111.89 24.05 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.219 1.408 . . . . 0.0 108.243 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.28 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 77.9 m -145.58 129.08 16.99 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.847 0.832 . . . . 0.0 110.998 -167.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 36.3 mtm -107.54 57.17 0.63 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.115 1.766 . . . . 0.0 107.521 -170.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 71.8 p -142.58 150.79 55.49 Favored Pre-proline 0 N--CA 1.45 -0.456 0 C-N-CA 123.34 0.656 . . . . 0.0 110.396 -164.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.99 -21.76 31.98 Favored 'Trans proline' 0 N--CA 1.454 -0.838 0 C-N-CA 122.26 1.974 . . . . 0.0 111.236 176.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -84.86 -14.88 68.88 Favored Glycine 0 CA--C 1.524 0.645 0 C-N-CA 124.723 1.154 . . . . 0.0 112.935 173.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -70.55 -38.98 68.67 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 118.582 1.191 . . . . 0.0 111.411 -177.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -92.5 -26.24 18.04 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 117.621 0.71 . . . . 0.0 112.445 -173.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 14.1 tt -63.72 -14.15 14.38 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 119.388 0.995 . . . . 0.0 111.451 174.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -50.34 -43.87 54.24 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.121 0.969 . . . . 0.0 110.551 171.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -59.64 -41.84 97.56 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.565 -0.614 . . . . 0.0 111.565 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.89 -37.11 75.93 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 117.622 0.711 . . . . 0.0 110.522 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -62.47 -48.77 78.14 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.567 0.747 . . . . 0.0 109.992 -176.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -63.0 -33.04 74.57 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.89 0.768 . . . . 0.0 110.737 175.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.22 -32.96 74.71 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 118.964 0.802 . . . . 0.0 111.992 174.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -70.2 -33.73 72.06 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 123.367 0.667 . . . . 0.0 109.545 -178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.1 -13.8 50.24 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-O 117.435 -1.269 . . . . 0.0 113.574 175.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 18.5 p -79.9 -9.46 59.68 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 121.012 1.733 . . . . 0.0 111.686 179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -121.14 26.78 8.78 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.458 1.103 . . . . 0.0 112.386 -163.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.2 mm -68.54 90.92 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 N-CA-C 106.343 -1.725 . . . . 0.0 106.343 176.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -90.13 -25.56 20.64 Favored 'General case' 0 C--O 1.234 0.288 0 O-C-N 121.569 -0.707 . . . . 0.0 111.108 169.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -133.87 166.65 22.19 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 126.167 1.787 . . . . 0.0 110.307 -177.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 4.6 m -160.21 146.59 15.67 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.54 1.536 . . . . 0.0 107.932 174.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -125.37 138.06 10.71 Favored Glycine 0 N--CA 1.444 -0.82 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 160.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 18.8 t -115.41 144.24 23.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 164.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -124.79 76.99 1.56 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 -173.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 16.5 mtp -81.16 27.31 0.41 Allowed 'General case' 0 C--O 1.23 0.069 0 C-N-CA 126.314 1.846 . . . . 0.0 113.821 -174.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 10.9 ttp85 -121.51 109.06 14.37 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -51.52 126.22 29.53 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 124.271 1.029 . . . . 0.0 110.629 -176.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -74.39 120.59 6.58 Favored 'Cis proline' 0 CA--C 1.534 0.52 0 O-C-N 122.63 0.805 . . . . 0.0 112.725 6.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 45.4 mt-30 -82.95 137.57 34.14 Favored 'General case' 0 C--O 1.237 0.403 0 O-C-N 121.835 -0.541 . . . . 0.0 110.409 -170.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -142.51 175.85 9.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.213 1.405 . . . . 0.0 107.573 177.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . 0.414 ' HB2' ' CE3' ' A' ' 28' ' ' TRP . 7.1 tmm? -128.25 157.44 40.88 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 126.725 2.01 . . . . 0.0 105.937 172.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -155.15 112.03 3.27 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 169.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.834 HD11 ' HB2' ' A' ' 138' ' ' LEU 0.333 0.4 OUTLIER -80.97 163.94 22.93 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 172.627 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 57.9 t -135.93 130.99 49.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 104.74 -2.319 . . . . 0.0 104.74 166.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 14.5 mt -83.11 164.8 20.03 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -54.7 -37.08 65.38 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.21 1.004 . . . . 0.0 111.679 173.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 25.1 p30 -80.22 -14.57 58.32 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.342 1.057 . . . . 0.0 111.993 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.38 -7.61 34.68 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 124.603 1.097 . . . . 0.0 114.613 174.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -55.02 144.65 22.75 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.265 1.532 . . . . 0.0 108.666 174.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 76.3 m -135.54 110.94 9.09 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 125.294 1.438 . . . . 0.0 108.013 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.834 ' HB2' HD11 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -105.86 155.83 18.93 Favored 'General case' 0 CA--C 1.506 -0.742 0 O-C-N 121.254 -0.903 . . . . 0.0 108.938 176.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 89.5 m -132.78 114.93 14.69 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 125.094 1.497 . . . . 0.0 108.946 -167.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.409 ' CD1' ' HE3' ' A' ' 128' ' ' MET . 8.7 m-85 -124.81 139.54 53.75 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -175.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 28' ' ' TRP . 0.3 OUTLIER -93.79 142.65 27.13 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 123.787 0.835 . . . . 0.0 109.078 178.706 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -65.68 119.5 11.28 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 116.382 -1.771 . . . . 0.0 109.694 178.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 5.7 t -124.08 38.34 4.21 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 121.671 2.032 . . . . 0.0 113.217 -172.145 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 14.3 p -74.89 17.2 0.23 Allowed 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 124.753 1.221 . . . . 0.0 112.214 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.973 0 C-N-CA 125.118 1.367 . . . . 0.0 113.292 173.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.3 pt . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.4 160.72 34.07 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.777 2.318 . . . . 0.0 112.017 176.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.03 -179.48 6.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 127.223 2.209 . . . . 0.0 107.394 173.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -89.51 165.11 27.03 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.305 1.042 . . . . 0.0 108.953 174.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -68.22 -10.52 29.19 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 122.791 2.328 . . . . 0.0 113.64 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 60.67 64.38 1.18 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 126.755 2.022 . . . . 0.0 111.503 -179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 t 75.13 -175.41 0.13 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 127.061 2.144 . . . . 0.0 110.928 177.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -110.68 63.19 0.61 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.913 1.285 . . . . 0.0 107.768 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -143.88 70.39 1.3 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.4 m -101.2 76.39 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 126.126 1.771 . . . . 0.0 107.467 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.7 154.94 33.08 Favored Pre-proline 0 CA--C 1.535 0.384 0 O-C-N 121.309 -0.869 . . . . 0.0 110.226 -179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -64.17 148.26 91.27 Favored 'Trans proline' 0 N--CA 1.454 -0.804 0 C-N-CA 122.022 1.815 . . . . 0.0 108.214 177.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.466 ' CG ' ' HD2' ' A' ' 14' ' ' PRO . 2.1 t70 -92.89 159.82 35.16 Favored Pre-proline 0 C--O 1.241 0.635 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.466 ' HD2' ' CG ' ' A' ' 13' ' ' ASP . 45.9 Cg_endo -69.79 -172.3 0.57 Allowed 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.555 2.837 . . . . 0.0 111.815 -177.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 75.27 159.26 0.22 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 128.08 2.552 . . . . 0.0 112.33 177.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.496 HD22 ' HB3' ' A' ' 18' ' ' ALA . 0.8 OUTLIER -147.39 149.79 35.55 Favored Pre-proline 0 CA--C 1.532 0.269 0 O-C-N 121.591 -0.693 . . . . 0.0 111.052 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -73.37 -32.34 8.2 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 123.891 3.06 . . . . 0.0 111.103 170.007 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.496 ' HB3' HD22 ' A' ' 16' ' ' ASN . . . -69.3 40.78 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.007 2.123 . . . . 0.0 112.243 175.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.626 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -143.03 -17.26 0.67 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 125.845 1.658 . . . . 0.0 112.069 -178.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -31.64 72.22 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 120.49 1.496 . . . . 0.0 111.272 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -57.73 -20.47 34.8 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 114.151 1.167 . . . . 0.0 114.151 -173.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -88.33 6.23 38.16 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.638 1.175 . . . . 0.0 111.158 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 74.9 mt -89.97 78.09 6.8 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 125.404 1.482 . . . . 0.0 108.373 177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -134.45 -27.78 1.33 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -128.24 0.93 5.77 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.954 1.702 . . . . 0.0 111.118 -175.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.9 p -74.27 -172.76 1.5 Allowed 'General case' 0 CA--C 1.527 0.078 0 C-N-CA 125.692 1.597 . . . . 0.0 111.465 -174.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.697 ' OG ' HG23 ' A' ' 55' ' ' THR . 0.4 OUTLIER -151.24 -63.9 0.19 Allowed 'General case' 0 CA--C 1.506 -0.726 0 O-C-N 120.453 -1.404 . . . . 0.0 110.536 -176.41 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 4.2 m95 65.12 159.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 123.227 1.489 . . . . 0.0 112.438 179.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.5 t -140.97 129.61 24.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 103.744 -2.687 . . . . 0.0 103.744 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.431 HD13 ' CE2' ' A' ' 140' ' ' PHE . 39.6 tp -66.91 154.8 40.11 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 106.654 -1.61 . . . . 0.0 106.654 172.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -150.09 -20.8 0.25 Allowed 'General case' 0 C--N 1.324 -0.526 0 O-C-N 120.46 -1.4 . . . . 0.0 111.67 169.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -144.26 140.05 29.0 Favored 'General case' 0 N--CA 1.442 -0.859 0 CA-C-N 118.753 0.706 . . . . 0.0 109.824 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -118.03 98.61 6.41 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.536 1.134 . . . . 0.0 108.442 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.55 134.33 34.83 Favored 'General case' 0 N--CA 1.453 -0.301 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 177.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -74.96 166.96 22.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 123.011 0.524 . . . . 0.0 109.599 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.38 16.93 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 129.395 3.078 . . . . 0.0 115.226 172.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -129.6 -18.38 3.53 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 127.377 2.271 . . . . 0.0 111.202 -179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 107.14 3.99 35.74 Favored Glycine 0 CA--C 1.538 1.482 0 C-N-CA 124.255 0.931 . . . . 0.0 113.914 -175.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.7 m -88.08 113.27 23.55 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.615 1.566 . . . . 0.0 111.747 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.48 108.82 2.11 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.767 1.227 . . . . 0.0 113.343 165.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.11 161.51 8.53 Favored 'General case' 0 C--O 1.238 0.484 0 C-N-CA 126.096 1.758 . . . . 0.0 112.09 176.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 128.65 38.15 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 117.995 -1.002 . . . . 0.0 108.59 161.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.6 m -144.46 163.57 33.45 Favored Pre-proline 0 CA--C 1.544 0.72 0 C-N-CA 126.027 1.731 . . . . 0.0 108.318 174.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -79.2 107.59 2.23 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 122.652 2.235 . . . . 0.0 110.756 172.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.99 169.48 6.73 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.213 1.005 . . . . 0.0 111.536 170.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.96 -54.8 32.79 Favored 'General case' 0 C--O 1.231 0.124 0 O-C-N 121.632 -0.668 . . . . 0.0 110.451 175.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.51 -10.53 52.56 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -176.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 59.4 mm-40 -75.99 -17.33 59.74 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.327 -0.844 . . . . 0.0 113.102 174.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 139.7 -88.34 0.2 Allowed Glycine 0 C--N 1.337 0.636 0 CA-C-N 119.306 0.957 . . . . 0.0 110.73 177.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.96 86.12 19.1 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 127.324 2.25 . . . . 0.0 109.129 -170.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -71.66 175.31 9.74 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.811 2.341 . . . . 0.0 112.079 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 63.1 mt -91.85 110.38 22.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 127.915 2.486 . . . . 0.0 109.276 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.5 p -114.91 117.59 31.08 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.74 1.616 . . . . 0.0 109.072 -176.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -81.99 165.33 20.78 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.697 HG23 ' OG ' ' A' ' 27' ' ' SER . 3.6 m -145.55 134.78 22.9 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 163.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.9 mt -119.99 97.87 5.81 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 174.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.3 t -150.66 159.36 44.56 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 -176.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -108.46 59.56 0.61 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 118.896 0.771 . . . . 0.0 109.924 -173.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -32.79 69.53 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.129 -0.357 . . . . 0.0 111.092 176.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.4 p -90.53 10.18 26.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 111.516 177.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.87 -14.24 0.41 Allowed Glycine 0 CA--C 1.53 0.99 0 C-N-CA 125.649 1.595 . . . . 0.0 113.596 -164.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -96.39 157.69 15.78 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 106.894 -1.521 . . . . 0.0 106.894 177.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 78' ' ' TYR . 7.6 ptp85 -68.29 72.67 0.2 Allowed 'General case' 0 C--N 1.318 -0.793 0 C-N-CA 126.17 1.788 . . . . 0.0 111.75 175.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -85.95 132.64 34.03 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.928 1.291 . . . . 0.0 110.854 176.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -100.7 118.04 36.02 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 166.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -137.14 154.89 50.15 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 168.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -175.33 169.68 42.56 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -175.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -96.96 125.49 41.42 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.509 ' HB2' ' CE2' ' A' ' 108' ' ' TYR . 28.3 t -109.27 91.1 3.51 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.949 0.795 . . . . 0.0 109.218 172.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 84.18 -64.84 4.2 Favored Glycine 0 C--N 1.332 0.355 0 CA-C-O 118.613 -1.104 . . . . 0.0 110.994 151.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 0.1 OUTLIER -134.41 -1.07 2.89 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 118.647 1.224 . . . . 0.0 111.854 163.508 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -144.73 118.86 9.45 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.532 1.133 . . . . 0.0 108.493 -163.404 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.44 160.86 27.5 Favored 'General case' 0 N--CA 1.473 0.722 0 O-C-N 120.762 -1.211 . . . . 0.0 113.325 173.479 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -133.35 170.38 15.55 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.567 2.747 . . . . 0.0 112.061 -176.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -153.59 166.78 31.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.612 1.565 . . . . 0.0 111.597 173.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.69 -163.84 30.52 Favored Glycine 0 CA--C 1.53 0.998 0 C-N-CA 125.661 1.601 . . . . 0.0 110.25 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 10.4 m -127.71 155.26 44.26 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 125.373 1.469 . . . . 0.0 109.824 -164.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 63' ' ' ARG . 52.3 p90 -138.97 179.47 6.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -174.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -147.82 148.2 30.65 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.297 1.839 . . . . 0.0 109.578 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.3 mp -117.31 103.78 10.49 Favored 'General case' 0 CA--C 1.514 -0.433 0 C-N-CA 127.248 2.219 . . . . 0.0 107.089 -179.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.39 -175.08 5.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 117.643 -1.17 . . . . 0.0 108.549 168.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 53.42 16.19 0.84 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 165.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.81 14.26 58.03 Favored Glycine 0 CA--C 1.527 0.807 0 O-C-N 120.051 -1.656 . . . . 0.0 114.285 -168.754 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.4 pttt -132.72 160.73 35.93 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 119.716 1.758 . . . . 0.0 111.26 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.515 ' O ' HG21 ' A' ' 115' ' ' ILE . 17.1 tp -107.51 102.83 12.06 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.737 -1.579 . . . . 0.0 106.737 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.2 p -97.75 132.55 43.27 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.501 0.721 . . . . 0.0 109.077 -178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -96.19 -176.76 3.76 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.868 1.267 . . . . 0.0 109.944 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.67 -153.79 8.91 Favored Glycine 0 CA--C 1.521 0.45 0 C-N-CA 125.624 1.583 . . . . 0.0 111.062 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -64.27 85.29 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 CA-C-O 123.228 1.489 . . . . 0.0 107.747 166.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 mt -78.34 178.31 7.77 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 119.923 -1.736 . . . . 0.0 108.52 169.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 146.97 -171.88 27.58 Favored Glycine 0 CA--C 1.522 0.503 0 C-N-CA 125.889 1.709 . . . . 0.0 109.41 171.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -179.43 -124.91 0.91 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 119.973 -1.108 . . . . 0.0 114.48 -171.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 21.1 p -102.59 169.67 8.5 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 124.346 1.058 . . . . 0.0 110.277 -165.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . 0.307 0.0 OUTLIER -128.05 40.91 3.59 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.294 1.038 . . . . 0.0 110.389 -174.914 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 15.0 mtt -58.8 140.9 54.44 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -91.14 124.89 35.7 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 170.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.274 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 91.3 m -136.99 169.09 18.35 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.121 1.368 . . . . 0.0 109.266 176.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 1.2 mtp -127.1 23.92 6.44 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.462 0.705 . . . . 0.0 110.26 -177.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 43.8 p -101.89 158.75 31.17 Favored Pre-proline 0 C--O 1.238 0.481 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 -168.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -74.22 -12.09 23.17 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 121.027 1.152 . . . . 0.0 112.159 171.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -92.61 -0.34 69.65 Favored Glycine 0 CA--C 1.524 0.642 0 CA-C-O 117.776 -1.569 . . . . 0.0 113.558 171.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -90.72 -45.67 4.19 Favored Glycine 0 CA--C 1.524 0.649 0 CA-C-N 120.239 2.019 . . . . 0.0 112.13 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -73.34 -22.5 60.29 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 118.812 1.306 . . . . 0.0 111.746 -174.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.7 tt -63.13 -14.33 13.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 O-C-N 121.503 -0.748 . . . . 0.0 112.352 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.514 ' HA ' ' CD1' ' A' ' 108' ' ' TYR . 5.3 tm-20 -66.56 -4.02 7.62 Favored 'General case' 0 C--O 1.22 -0.5 0 C-N-CA 126.502 1.921 . . . . 0.0 112.759 173.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -79.95 -64.17 1.9 Allowed Glycine 0 CA--C 1.533 1.214 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 164.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -62.4 -33.29 74.47 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 121.287 -1.125 . . . . 0.0 112.626 -169.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.685 ' CE1' HD13 ' A' ' 109' ' ' LEU . 0.4 OUTLIER -63.6 -36.59 84.31 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.503 0.721 . . . . 0.0 110.428 -171.398 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.685 HD13 ' CE1' ' A' ' 108' ' ' TYR . 0.0 OUTLIER -75.43 -23.21 56.93 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 124.694 1.198 . . . . 0.0 111.117 176.65 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -80.18 -24.17 40.51 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 171.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.95 -39.74 61.17 Favored 'General case' 0 N--CA 1.444 -0.728 0 C-N-CA 123.218 0.607 . . . . 0.0 109.493 173.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 20.2 mt -61.3 -14.51 27.32 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.761 1.393 . . . . 0.0 114.761 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 56.8 p -82.35 -4.31 57.04 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 120.671 1.578 . . . . 0.0 112.494 175.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -118.2 84.07 2.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.229 1.412 . . . . 0.0 109.252 -172.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.515 HG21 ' O ' ' A' ' 85' ' ' LEU . 4.5 mm -128.37 60.34 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.361 0 N-CA-C 107.278 -1.379 . . . . 0.0 107.278 177.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.29 -29.48 66.24 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 122.556 1.169 . . . . 0.0 110.048 171.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.542 ' CG ' ' HB ' ' A' ' 131' ' ' VAL . 0.0 OUTLIER -141.03 158.29 44.14 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-O 123.03 1.395 . . . . 0.0 112.781 -178.507 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 130' ' ' LEU . 21.0 m -151.41 171.98 16.66 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 125.336 1.454 . . . . 0.0 108.495 174.245 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.64 99.33 0.18 Allowed Glycine 0 CA--C 1.525 0.656 0 N-CA-C 108.528 -1.829 . . . . 0.0 108.528 172.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.626 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.7 p -100.61 136.24 33.0 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 O-C-N 121.263 -1.139 . . . . 0.0 108.987 177.277 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -107.8 76.65 1.07 Allowed 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.262 -1.755 . . . . 0.0 106.262 178.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.574 ' CG ' ' HB1' ' A' ' 19' ' ' ALA . 79.0 mmm -71.74 50.92 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 O-C-N 120.707 -1.245 . . . . 0.0 111.824 175.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 3.5 tpp85 -134.99 129.12 33.66 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -66.19 130.03 94.26 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 117.647 -1.168 . . . . 0.0 109.849 179.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.89 119.45 6.16 Favored 'Cis proline' 0 CA--C 1.54 0.81 0 CA-C-N 119.7 0.928 . . . . 0.0 112.824 3.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -84.76 131.78 34.52 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 124.92 1.288 . . . . 0.0 109.691 -168.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -141.85 167.96 20.89 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 125.803 1.641 . . . . 0.0 108.95 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 7.5 tmm? -122.75 134.99 54.43 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 176.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -119.1 144.44 46.6 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 162.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.87 ' H ' HD12 ' A' ' 130' ' ' LEU 0.305 0.1 OUTLIER -112.64 167.71 10.25 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.03 0.932 . . . . 0.0 109.072 160.491 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.542 ' HB ' ' CG ' ' A' ' 117' ' ' ARG . 59.4 t -124.0 147.87 28.32 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 157.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 13.7 mt -91.11 161.03 15.27 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 172.18 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -55.21 -25.05 30.54 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 119.334 0.97 . . . . 0.0 111.526 -176.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -82.43 -19.35 39.18 Favored 'General case' 0 C--N 1.342 0.271 0 C-N-CA 125.263 1.425 . . . . 0.0 112.009 -178.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 113.94 -9.51 23.21 Favored Glycine 0 CA--C 1.53 1.012 0 C-N-CA 125.591 1.567 . . . . 0.0 114.484 -177.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 148.19 23.97 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 119.64 1.72 . . . . 0.0 109.421 -179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -138.06 99.02 3.77 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.978 0.911 . . . . 0.0 108.682 -168.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 130' ' ' LEU . 6.4 mp -86.75 142.7 27.95 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 119.733 -1.855 . . . . 0.0 108.504 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 90.1 m -109.22 125.22 52.01 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 125.755 1.622 . . . . 0.0 107.822 178.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.431 ' CE2' HD13 ' A' ' 30' ' ' LEU . 57.4 m-85 -119.17 151.34 38.5 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 124.048 0.939 . . . . 0.0 110.453 176.388 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -99.32 147.83 24.79 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 125.937 1.695 . . . . 0.0 108.824 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.9 tpt180 -76.06 111.49 11.51 Favored 'General case' 0 CA--C 1.517 -0.321 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 177.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 6.5 t -111.43 93.95 4.72 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 168.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 9.4 t -117.4 26.37 9.79 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.629 1.571 . . . . 0.0 110.012 169.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.297 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.471 0.604 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -62.04 173.38 3.18 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 121.643 1.562 . . . . 0.0 110.722 170.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.53 174.92 8.31 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 163.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 59.3 m170 -64.83 165.11 16.66 Favored Pre-proline 0 CA--C 1.539 0.556 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 153.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.05 71.14 3.58 Favored 'Trans proline' 0 CA--C 1.543 0.945 0 C-N-CA 122.364 2.043 . . . . 0.0 110.682 170.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -143.57 89.98 2.12 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 128.58 2.752 . . . . 0.0 104.428 168.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -174.87 176.69 2.15 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.662 1.585 . . . . 0.0 108.226 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 64.54 19.37 11.79 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 126.873 2.069 . . . . 0.0 116.473 152.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.16 46.47 2.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.315 1.046 . . . . 0.0 110.197 171.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.0 t -136.54 134.3 49.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -175.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.7 151.57 92.06 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 123.827 0.851 . . . . 0.0 110.83 177.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -74.78 126.83 10.37 Favored 'Trans proline' 0 N--CA 1.454 -0.831 0 C-N-CA 122.675 2.25 . . . . 0.0 111.645 -173.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -81.67 144.82 53.15 Favored Pre-proline 0 CA--C 1.542 0.658 0 C-N-CA 125.381 1.472 . . . . 0.0 108.958 174.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -71.04 177.88 5.98 Favored 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 123.711 2.94 . . . . 0.0 112.583 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 51.85 47.19 25.26 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.825 1.65 . . . . 0.0 110.677 -175.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -70.99 143.68 89.22 Favored Pre-proline 0 N--CA 1.454 -0.256 0 CA-C-O 117.681 -1.152 . . . . 0.0 108.883 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -78.69 -16.75 12.89 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.959 2.439 . . . . 0.0 112.073 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.91 39.93 0.14 Allowed 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 122.751 1.262 . . . . 0.0 111.602 174.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.424 ' HB1' ' HG3' ' A' ' 122' ' ' MET . . . -139.43 -46.22 0.46 Allowed 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 130.065 3.346 . . . . 0.0 106.4 -176.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.481 ' HA ' HD23 ' A' ' 23' ' ' LEU . 0.6 OUTLIER -60.83 -20.69 62.16 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.593 1.157 . . . . 0.0 112.843 -176.123 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.3 -12.0 54.01 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 116.932 -1.508 . . . . 0.0 114.773 174.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.25 7.18 46.61 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.565 1.546 . . . . 0.0 110.589 178.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 20' ' ' THR . 2.7 mm? -82.15 56.32 3.14 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 120.381 -1.449 . . . . 0.0 109.312 -176.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -135.57 -40.22 0.71 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 118.623 -0.703 . . . . 0.0 112.296 -161.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -130.1 39.43 3.67 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 172.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 20.3 p -120.92 157.74 29.2 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 120.506 -1.371 . . . . 0.0 110.975 -174.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t -127.6 152.47 47.6 Favored 'General case' 0 CA--C 1.507 -0.699 0 C-N-CA 123.99 0.916 . . . . 0.0 109.106 -178.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 60.7 m95 -149.59 162.5 40.07 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-N 113.257 -1.792 . . . . 0.0 108.604 -166.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.7 t -147.58 136.04 15.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.474 HD13 ' CZ ' ' A' ' 140' ' ' PHE . 17.2 tp -82.25 150.65 27.19 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 119.276 0.944 . . . . 0.0 110.311 -179.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 22.2 t -134.31 -27.32 1.39 Allowed 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 175.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -151.79 157.97 42.68 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 120.309 1.413 . . . . 0.0 110.389 177.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.745 ' CD1' HD21 ' A' ' 138' ' ' LEU . 1.2 t90 -143.35 106.6 4.55 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.082 2.153 . . . . 0.0 108.469 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.07 131.61 34.07 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 172.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -61.53 161.61 9.38 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 159.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -44.32 -42.95 7.14 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.158 1.783 . . . . 0.0 112.654 165.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.23 -14.23 62.17 Favored 'General case' 0 C--N 1.341 0.198 0 C-N-CA 125.683 1.593 . . . . 0.0 111.987 -173.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.55 1.72 58.93 Favored Glycine 0 CA--C 1.531 1.062 0 C-N-CA 125.948 1.737 . . . . 0.0 112.64 -175.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.1 m -69.4 108.89 3.92 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.073 1.749 . . . . 0.0 109.794 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.39 140.36 48.35 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.153 -0.967 . . . . 0.0 110.64 170.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 1.8 mtt-85 -97.05 166.47 11.58 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 125.436 1.494 . . . . 0.0 111.606 -175.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -85.5 102.99 13.96 Favored 'General case' 0 C--N 1.332 -0.174 0 O-C-N 121.526 -0.734 . . . . 0.0 109.485 173.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 28.0 m -114.43 148.89 41.21 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 173.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.7 102.69 1.64 Allowed 'Trans proline' 0 N--CA 1.454 -0.8 0 C-N-CA 123.137 2.558 . . . . 0.0 110.203 -176.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.08 169.31 0.4 Allowed 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 126.162 1.785 . . . . 0.0 114.442 168.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.87 -37.38 71.26 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.046 0.938 . . . . 0.0 112.873 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -80.86 -15.2 57.0 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -73.85 -22.92 59.59 Favored 'General case' 0 C--O 1.235 0.308 0 O-C-N 121.589 -0.694 . . . . 0.0 111.515 -172.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.56 -32.14 2.34 Favored Glycine 0 C--N 1.337 0.604 0 N-CA-C 115.335 0.894 . . . . 0.0 115.335 156.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -145.17 85.26 8.2 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 172.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 162.28 39.82 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 122.035 1.823 . . . . 0.0 111.22 -178.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.7 mt -77.99 106.85 9.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 C-N-CA 124.537 1.135 . . . . 0.0 109.093 -176.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 36.3 p -99.41 159.02 15.32 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.377 0.671 . . . . 0.0 109.629 175.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 20.4 tp -140.16 141.97 36.0 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 127.402 2.281 . . . . 0.0 106.465 165.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 86.2 m -134.37 145.84 49.35 Favored 'General case' 0 C--N 1.323 -0.558 0 O-C-N 120.833 -1.167 . . . . 0.0 108.146 159.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.4 mt -118.4 117.32 28.74 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 103.71 -2.7 . . . . 0.0 103.71 -179.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.2 t -163.54 178.7 7.79 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 171.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 54.0 p -116.92 16.46 15.16 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 113.753 1.02 . . . . 0.0 113.753 -161.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -51.72 -32.68 31.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 82.1 p -65.97 -21.82 66.44 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 121.336 1.88 . . . . 0.0 111.875 176.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 96.92 -0.03 60.47 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 125.897 1.713 . . . . 0.0 111.01 -160.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 mp0 -131.27 167.8 18.6 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 119.106 1.453 . . . . 0.0 109.771 171.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -71.51 80.38 0.79 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.732 2.013 . . . . 0.0 106.742 173.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -106.07 112.79 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.518 1.527 . . . . 0.0 109.083 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.54 149.88 45.32 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 168.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 2.0 p -145.65 152.42 39.62 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 167.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 176.71 -168.74 40.9 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.018 -0.833 . . . . 0.0 111.018 -177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.402 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 6.0 t80 -131.55 128.73 39.86 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 103.34 -2.837 . . . . 0.0 103.34 172.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.4 m -119.59 11.19 11.97 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.443 1.02 . . . . 0.0 113.594 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 169.25 -63.09 0.18 Allowed Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.295 -1.281 . . . . 0.0 112.122 168.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 9.2 t -166.96 9.99 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 119.632 1.716 . . . . 0.0 113.713 177.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -112.06 -7.66 14.08 Favored 'General case' 0 C--N 1.322 -0.607 0 O-C-N 118.813 -2.429 . . . . 0.0 112.92 173.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.402 ' HA ' ' HA ' ' A' ' 68' ' ' PHE 0.321 0.0 OUTLIER 44.21 179.67 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 127.615 2.366 . . . . 0.0 113.07 -164.246 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 10.2 p90 -160.25 166.77 28.94 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.168 -1.378 . . . . 0.0 111.645 177.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -157.37 168.3 27.77 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.957 2.503 . . . . 0.0 106.392 173.178 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 143.9 175.88 17.42 Favored Glycine 0 CA--C 1.527 0.829 0 C-N-CA 124.431 1.015 . . . . 0.0 110.876 174.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 50.4 m -79.54 164.43 23.88 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -166.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -142.55 176.84 8.72 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.642 1.177 . . . . 0.0 111.541 170.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -158.3 159.23 35.71 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.147 1.379 . . . . 0.0 110.283 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 75.9 mt -122.87 128.62 50.6 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 125.385 1.474 . . . . 0.0 108.817 -177.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 13.9 ptmt 176.18 171.58 0.4 Allowed 'General case' 0 CA--C 1.518 -0.272 0 C-N-CA 128.111 2.564 . . . . 0.0 107.175 -171.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t0 58.3 24.13 11.21 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 158.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.01 5.78 59.0 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 118.251 -1.305 . . . . 0.0 113.998 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.435 ' HA ' HG21 ' A' ' 20' ' ' THR . 14.5 pttt -131.31 168.41 17.59 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 119.806 1.803 . . . . 0.0 112.122 -171.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 14.5 tp -101.89 109.65 21.44 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 105.336 -2.098 . . . . 0.0 105.336 163.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -90.7 159.48 16.34 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -120.1 178.88 4.46 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.497 1.119 . . . . 0.0 110.126 178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -101.87 -112.11 3.55 Favored Glycine 0 C--N 1.332 0.352 0 N-CA-C 110.301 -1.12 . . . . 0.0 110.301 175.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.5 t -143.86 67.16 1.28 Allowed 'General case' 0 N--CA 1.441 -0.89 0 C-N-CA 128.242 2.617 . . . . 0.0 105.284 -162.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.716 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -68.26 163.74 22.21 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.159 0.984 . . . . 0.0 111.031 -171.618 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -175.89 172.83 45.81 Favored Glycine 0 N--CA 1.45 -0.428 0 N-CA-C 110.621 -0.992 . . . . 0.0 110.621 166.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -144.34 -134.46 2.8 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 110.307 -1.117 . . . . 0.0 110.307 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 67.2 p -103.22 -167.96 1.45 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.75 1.62 . . . . 0.0 109.774 -176.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -128.24 67.47 1.36 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.045 1.738 . . . . 0.0 109.481 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 47.7 mtm -101.14 157.26 16.9 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 121.603 -0.685 . . . . 0.0 109.165 -176.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -119.27 118.72 32.01 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.038 0.935 . . . . 0.0 108.643 -171.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.266 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 0.5 OUTLIER -102.37 -22.87 14.03 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 177.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . 0.256 23.2 ptp 49.49 31.36 3.98 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -169.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 61.1 p -122.64 160.71 47.47 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.502 1.521 . . . . 0.0 107.47 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.8 -41.67 7.7 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 121.727 1.618 . . . . 0.0 111.632 179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -66.93 -30.96 76.8 Favored Glycine 0 C--N 1.34 0.762 0 CA-C-O 118.699 -1.056 . . . . 0.0 111.005 177.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -68.98 -17.04 71.26 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 119.899 1.85 . . . . 0.0 113.242 173.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -98.91 -12.12 21.02 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 118.577 1.189 . . . . 0.0 112.385 -173.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.7 tt -81.95 -16.13 12.0 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -174.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -58.22 -37.65 75.26 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.911 0.778 . . . . 0.0 110.545 -174.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -65.67 -28.53 73.71 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-O 118.628 -1.095 . . . . 0.0 113.464 176.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.7 59.75 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 120.097 1.949 . . . . 0.0 110.158 173.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -71.52 -44.22 65.05 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.5 1.12 . . . . 0.0 110.668 -174.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 5.9 mp -60.81 -28.17 68.59 Favored 'General case' 0 N--CA 1.475 0.787 0 O-C-N 120.566 -1.334 . . . . 0.0 111.272 172.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.56 -20.57 50.3 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 174.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -82.2 -37.61 25.8 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 125.457 1.503 . . . . 0.0 109.927 178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.14 -13.77 0.55 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 127.676 2.391 . . . . 0.0 114.584 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 6.3 p -114.96 -0.32 13.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.697 1.599 . . . . 0.0 113.09 -176.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.9 m-70 -110.51 35.38 3.49 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 119.629 1.104 . . . . 0.0 109.973 172.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.3 mm -71.65 74.4 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 124.839 1.256 . . . . 0.0 108.017 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -84.87 -25.77 27.79 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 121.392 -0.817 . . . . 0.0 109.987 173.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -137.37 164.97 27.33 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 122.445 1.117 . . . . 0.0 112.609 174.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.4 m -158.6 162.91 37.36 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 127.577 2.351 . . . . 0.0 107.126 -176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -166.02 91.81 0.1 Allowed Glycine 0 CA--C 1.524 0.643 0 N-CA-C 108.791 -1.724 . . . . 0.0 108.791 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 128' ' ' MET . 2.2 p -77.53 145.75 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 O-C-N 120.229 -1.748 . . . . 0.0 109.242 166.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -120.31 98.54 6.1 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 126.453 1.901 . . . . 0.0 107.401 174.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.424 ' HG3' ' HB1' ' A' ' 19' ' ' ALA . 12.2 mtp -88.42 1.79 54.01 Favored 'General case' 0 N--CA 1.463 0.195 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 177.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.3 tpp180 -61.81 132.08 51.96 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 157.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.04 140.73 98.16 Favored Pre-proline 0 N--CA 1.442 -0.852 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 170.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.42 118.68 4.71 Favored 'Cis proline' 0 N--CA 1.454 -0.8 0 CA-C-N 119.861 0.986 . . . . 0.0 110.558 -1.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 54.6 mt-30 -68.46 127.32 32.57 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.742 0.782 . . . . 0.0 109.213 -172.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -140.41 161.49 37.57 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.286 178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . 0.402 ' HA ' ' HA ' ' A' ' 120' ' ' VAL . 40.2 ttp -115.39 148.87 38.81 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 167.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -130.21 133.61 46.68 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 176.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 52.7 mt -119.11 154.01 33.9 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 173.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.9 t -142.26 126.63 16.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -177.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.7 mt -84.45 170.91 13.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.452 . . . . 0.0 111.224 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -63.05 -2.17 1.18 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.56 1.944 . . . . 0.0 114.543 177.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -109.39 -10.29 14.92 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.89 1.676 . . . . 0.0 112.163 172.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 102.79 18.57 15.34 Favored Glycine 0 C--N 1.334 0.445 0 O-C-N 120.896 -1.128 . . . . 0.0 114.249 169.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.97 167.87 3.56 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.311 1.044 . . . . 0.0 110.982 174.973 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 5.0 m -139.66 104.15 4.85 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.348 -0.845 . . . . 0.0 109.059 -178.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.745 HD21 ' CD1' ' A' ' 33' ' ' TRP . 0.6 OUTLIER -92.57 160.74 14.89 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.907 -1.12 . . . . 0.0 110.973 179.071 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . 0.401 ' O ' HD12 ' A' ' 30' ' ' LEU . 2.6 m -134.85 110.7 9.34 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 122.572 0.349 . . . . 0.0 111.201 -174.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.474 ' CZ ' HD13 ' A' ' 30' ' ' LEU . 77.7 m-85 -114.06 140.98 48.02 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 123.972 0.795 . . . . 0.0 110.387 173.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -85.97 147.27 26.3 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 163.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -64.51 137.07 57.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 160.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 36.5 t -123.91 104.58 9.01 Favored 'General case' 0 CA--C 1.508 -0.662 0 CA-C-N 120.197 1.362 . . . . 0.0 107.99 163.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.3 t -123.12 17.59 9.97 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 123.489 0.493 . . . . 0.0 111.316 174.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 7.5 mmp_? . . . . . 0 C--O 1.251 1.172 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 154.499 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 8.5 pt . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 120.358 0.123 . . . . 0.0 110.68 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -71.39 151.66 59.89 Favored 'Trans proline' 0 CA--C 1.535 0.571 0 C-N-CA 122.707 2.271 . . . . 0.0 110.401 172.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.84 136.38 28.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 169.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -87.81 167.61 19.73 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 126.381 1.873 . . . . 0.0 110.611 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -76.48 -5.28 15.97 Favored 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.853 2.369 . . . . 0.0 113.937 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 59.17 21.02 9.05 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 126.064 1.745 . . . . 0.0 112.656 175.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 20.0 m -73.64 105.34 4.92 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 124.564 1.146 . . . . 0.0 110.42 -175.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -162.64 108.15 1.18 Allowed 'General case' 0 N--CA 1.437 -1.098 0 C-N-CA 128.592 2.757 . . . . 0.0 107.548 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . 76.28 62.79 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 C-N-CA 128.731 2.812 . . . . 0.0 110.323 170.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -115.77 155.11 17.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.583 0 C-N-CA 125.391 1.477 . . . . 0.0 109.558 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.16 156.86 66.37 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 126.398 1.879 . . . . 0.0 110.981 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -72.01 152.0 56.66 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.313 2.008 . . . . 0.0 110.459 176.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -68.85 159.63 81.53 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 125.103 1.361 . . . . 0.0 110.594 174.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_endo -72.54 -167.87 0.36 Allowed 'Trans proline' 0 CA--C 1.541 0.832 0 C-N-CA 124.065 3.177 . . . . 0.0 111.307 171.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 75.07 171.45 0.28 Allowed 'General case' 0 C--O 1.235 0.307 0 C-N-CA 128.115 2.566 . . . . 0.0 110.704 176.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -159.25 144.13 11.51 Favored Pre-proline 0 N--CA 1.468 0.47 0 O-C-N 121.301 -0.875 . . . . 0.0 111.583 173.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -74.79 -18.98 18.86 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 122.317 2.012 . . . . 0.0 111.942 177.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -13.32 23.62 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 119.23 0.923 . . . . 0.0 112.388 173.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.443 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.68 -25.64 49.68 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 119.726 1.148 . . . . 0.0 112.702 172.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -63.33 -31.02 72.07 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 123.822 0.849 . . . . 0.0 112.389 -160.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -21.8 66.4 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.753 0.706 . . . . 0.0 112.23 -175.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 56.0 mt -83.84 -9.43 58.77 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.449 1.1 . . . . 0.0 111.465 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.95 -13.52 62.49 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.813 0.845 . . . . 0.0 112.098 -172.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -60.46 -9.82 4.15 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.801 2.04 . . . . 0.0 112.87 177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -128.58 10.0 6.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 126.595 1.958 . . . . 0.0 111.483 -165.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 57.8 p -113.69 -174.76 2.53 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 120.937 -1.102 . . . . 0.0 111.463 -162.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.504 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -153.01 -66.58 0.16 Allowed 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 118.211 -0.9 . . . . 0.0 112.186 -171.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 1.4 m95 65.88 171.29 0.23 Allowed 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.91 1.284 . . . . 0.0 113.769 176.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 26.7 t -139.12 135.84 42.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 104.033 -2.58 . . . . 0.0 104.033 172.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.2 tp -74.44 143.24 44.79 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 172.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.83 -21.34 0.72 Allowed 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 115.079 1.511 . . . . 0.0 115.079 175.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -142.49 166.89 23.44 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 120.632 1.56 . . . . 0.0 111.388 167.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.476 ' CZ3' ' CE1' ' A' ' 108' ' ' TYR . 5.9 t90 -150.65 101.48 2.94 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.06 2.144 . . . . 0.0 107.492 -176.02 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.6 145.11 25.89 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 170.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -88.44 172.31 9.46 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.386 0.674 . . . . 0.0 109.542 162.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -59.91 -34.48 73.25 Favored 'General case' 0 C--N 1.333 -0.119 0 C-N-CA 124.273 1.029 . . . . 0.0 112.836 -177.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.55 5.41 20.93 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.047 0.451 . . . . 0.0 110.823 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 91.61 11.66 60.41 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 125.221 1.391 . . . . 0.0 111.439 178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 m -74.19 99.32 3.37 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 120.85 -1.383 . . . . 0.0 108.398 -174.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.5 104.36 1.24 Allowed 'General case' 0 C--O 1.238 0.483 0 CA-C-O 122.158 0.98 . . . . 0.0 108.878 168.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 31.9 mtt180 -59.4 157.5 11.01 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.78 1.232 . . . . 0.0 110.118 175.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -75.74 124.36 27.15 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 168.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 34.9 m -131.17 150.19 75.81 Favored Pre-proline 0 CA--C 1.539 0.538 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.78 104.44 1.91 Allowed 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.951 2.434 . . . . 0.0 110.179 -175.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 169.26 11.24 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.006 1.322 . . . . 0.0 108.565 173.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -53.93 -46.43 71.53 Favored 'General case' 0 C--O 1.23 0.067 0 O-C-N 121.786 -0.571 . . . . 0.0 111.618 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.34 -10.4 58.91 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -76.33 -12.04 60.0 Favored 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 123.851 0.86 . . . . 0.0 112.152 172.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 121.15 -32.97 4.54 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 124.337 0.97 . . . . 0.0 112.723 174.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -140.14 85.85 13.53 Favored Pre-proline 0 N--CA 1.449 -0.486 0 C-N-CA 125.993 1.717 . . . . 0.0 109.268 -171.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -65.3 132.8 32.69 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.76 1.64 . . . . 0.0 108.676 168.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 72.3 mt -69.99 98.95 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 O-C-N 121.913 -0.492 . . . . 0.0 109.821 173.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.9 p -75.9 154.0 36.32 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 171.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -124.67 155.04 39.85 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 104.444 -2.428 . . . . 0.0 104.444 172.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 17.6 m -141.9 137.4 31.32 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 85' ' ' LEU . 87.1 mt -128.99 60.4 1.55 Allowed 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 125.272 1.429 . . . . 0.0 107.947 174.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.8 t -134.78 172.32 13.13 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.629 1.172 . . . . 0.0 108.238 -171.421 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 41.4 p -95.52 44.2 1.09 Allowed 'General case' 0 C--N 1.326 -0.434 0 O-C-N 120.282 -1.511 . . . . 0.0 111.408 -160.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.83 -13.38 6.04 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.852 1.427 . . . . 0.0 114.852 -176.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 p -121.18 0.03 10.04 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 127.158 2.183 . . . . 0.0 112.411 170.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 103.17 -39.79 2.66 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 127.991 2.71 . . . . 0.0 111.897 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 13.0 mp0 -82.97 172.88 12.31 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 124.05 0.94 . . . . 0.0 108.691 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ptp85 -75.87 76.47 2.79 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.956 0.884 . . . . 0.0 110.484 171.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -102.98 123.82 47.31 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.946 1.698 . . . . 0.0 106.992 175.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.96 144.49 31.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 125.872 1.669 . . . . 0.0 107.138 174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.25 173.54 11.57 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 164.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.03 -168.72 38.57 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 108.39 -1.884 . . . . 0.0 108.39 174.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -135.02 95.19 3.26 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.0 m -73.66 77.37 1.52 Allowed 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.054 1.341 . . . . 0.0 110.868 173.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 73.07 -63.57 1.65 Allowed Glycine 0 C--N 1.333 0.373 0 C-N-CA 125.003 1.287 . . . . 0.0 113.857 158.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.7 m -114.22 -16.95 11.97 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 119.509 1.655 . . . . 0.0 111.219 170.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -139.71 124.56 18.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 -157.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 6.6 ptt180 -73.9 162.66 28.85 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 122.822 1.296 . . . . 0.0 111.41 163.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.7 p90 -145.7 146.8 31.41 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 130.8 3.64 . . . . 0.0 107.049 -175.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 35.0 mtm -147.29 152.24 37.95 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.5 2.32 . . . . 0.0 106.404 -179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 164.23 175.22 34.86 Favored Glycine 0 C--N 1.32 -0.356 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 174.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 17.6 m -78.92 155.03 29.19 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.817 0.808 . . . . 0.0 111.168 -175.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 49.1 p90 -125.69 177.14 6.43 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.714 1.205 . . . . 0.0 110.558 167.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -151.4 153.49 34.81 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.099 1.76 . . . . 0.0 109.484 174.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.49 101.3 9.74 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 126.884 2.073 . . . . 0.0 105.666 178.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.2 ptmt -154.8 158.88 40.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.487 -174.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.0 t0 44.59 33.42 0.92 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.138 1.375 . . . . 0.0 114.692 179.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.41 ' O ' HG21 ' A' ' 118' ' ' THR . . . 65.39 5.14 20.56 Favored Glycine 0 CA--C 1.53 1.025 0 CA-C-O 118.171 -1.349 . . . . 0.0 114.808 -175.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.3 pttt -123.51 145.64 48.7 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 120.099 1.95 . . . . 0.0 110.986 -172.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.407 HD11 HD11 ' A' ' 56' ' ' LEU . 0.2 OUTLIER -71.82 119.9 16.65 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.877 -1.897 . . . . 0.0 105.877 169.929 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 4.8 p -123.98 152.44 42.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 119.037 0.835 . . . . 0.0 109.536 177.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.541 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.9 m-85 -119.59 175.15 5.99 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -172.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -104.16 -112.48 3.71 Favored Glycine 0 CA--C 1.526 0.738 0 C-N-CA 125.322 1.439 . . . . 0.0 110.458 174.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 8.8 t -132.08 70.9 1.46 Allowed 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 127.996 2.519 . . . . 0.0 105.44 -163.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.751 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.8 OUTLIER -71.57 151.77 43.52 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 114.343 -1.298 . . . . 0.0 110.26 -172.286 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 168.14 162.99 21.3 Favored Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 107.315 -2.314 . . . . 0.0 107.315 172.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.17 -27.19 0.06 OUTLIER Glycine 0 CA--C 1.507 -0.42 0 C-N-CA 119.602 -1.285 . . . . 0.0 113.698 178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 39.5 p -163.85 170.01 17.42 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 128.346 2.658 . . . . 0.0 109.272 -167.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 4.3 mmm180 -128.85 29.35 5.24 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.793 1.637 . . . . 0.0 110.334 -175.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 24.6 mtt -60.38 141.28 56.52 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.133 0.973 . . . . 0.0 111.137 -168.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -105.57 124.68 49.95 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.227 1.411 . . . . 0.0 108.49 176.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.269 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 59.2 m -127.01 167.85 15.35 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.001 0.92 . . . . 0.0 109.893 168.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 2.5 mtp -120.56 47.01 1.87 Allowed 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 106.541 -1.651 . . . . 0.0 106.541 -177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 75.9 p -132.83 156.98 79.48 Favored Pre-proline 0 C--O 1.241 0.649 0 C-N-CA 125.97 1.708 . . . . 0.0 108.128 177.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -60.24 -47.95 13.24 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.967 2.444 . . . . 0.0 110.819 174.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -67.24 -11.37 58.93 Favored Glycine 0 CA--C 1.534 1.23 0 CA-C-O 118.922 -0.932 . . . . 0.0 112.115 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -79.85 -60.22 2.48 Favored Glycine 0 CA--C 1.525 0.691 0 CA-C-N 119.148 1.474 . . . . 0.0 111.521 173.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -75.95 -18.07 59.48 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 118.528 1.164 . . . . 0.0 113.939 -168.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.6 tt -60.97 -21.03 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 124.155 0.982 . . . . 0.0 112.467 176.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -45.77 -46.11 15.06 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 126.149 1.78 . . . . 0.0 110.52 174.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -66.08 -34.96 89.83 Favored Glycine 0 CA--C 1.533 1.158 0 O-C-N 120.77 -1.206 . . . . 0.0 113.042 178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.15 75.46 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 119.691 1.746 . . . . 0.0 110.358 173.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . 0.476 ' CE1' ' CZ3' ' A' ' 33' ' ' TRP . 10.1 m-85 -60.31 -62.09 2.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 125.079 1.352 . . . . 0.0 109.782 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 24.7 mt -69.86 -23.29 63.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.426 -173.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -61.78 -59.21 5.5 Favored 'General case' 0 CA--C 1.518 -0.281 0 C-N-CA 123.012 0.525 . . . . 0.0 110.199 168.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -61.56 -29.82 70.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.907 1.283 . . . . 0.0 110.902 -176.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 4.5 tp -56.59 -21.21 25.23 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.935 1.294 . . . . 0.0 112.992 -175.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 23.6 p -85.96 -23.19 27.02 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 120.423 1.465 . . . . 0.0 112.223 177.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 84.4 m-70 -94.42 37.95 1.11 Allowed 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.475 1.51 . . . . 0.0 111.338 -166.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.7 mm -75.96 79.92 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 N-CA-C 105.099 -2.186 . . . . 0.0 105.099 174.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -79.69 -30.31 41.06 Favored 'General case' 0 C--N 1.33 -0.246 0 O-C-N 121.433 -0.792 . . . . 0.0 109.982 178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.401 ' HE ' HG12 ' A' ' 131' ' ' VAL . 20.5 mtm180 -132.98 173.62 11.21 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 127.549 2.34 . . . . 0.0 109.434 -176.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.41 HG21 ' O ' ' A' ' 83' ' ' GLY . 4.8 t -159.23 -179.49 8.03 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.322 -0.861 . . . . 0.0 110.324 -172.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -172.48 84.57 0.08 OUTLIER Glycine 0 CA--C 1.53 0.978 0 C-N-CA 123.691 0.663 . . . . 0.0 112.046 171.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.443 HG13 ' HB3' ' A' ' 19' ' ' ALA 0.293 1.7 p -88.88 120.96 38.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-N 119.101 1.45 . . . . 0.0 109.863 171.515 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -90.09 96.52 10.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 175.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 43.6 tpp -87.71 60.29 5.87 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 122.582 1.182 . . . . 0.0 108.181 177.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 8.0 ttm180 -153.38 135.95 15.16 Favored 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 104.753 -2.314 . . . . 0.0 104.753 171.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -64.25 150.31 92.89 Favored Pre-proline 0 N--CA 1.443 -0.822 0 CA-C-N 118.568 0.622 . . . . 0.0 110.212 175.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -69.5 119.05 3.65 Favored 'Cis proline' 0 N--CA 1.459 -0.536 0 CA-C-N 119.336 0.799 . . . . 0.0 110.262 -8.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -72.5 127.31 32.17 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 122.208 1.004 . . . . 0.0 108.514 -168.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -142.77 159.68 41.77 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 126.209 1.804 . . . . 0.0 106.527 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 34.7 ttp -142.17 104.61 4.48 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -165.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -69.78 144.49 52.66 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 161.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 85.0 mt -115.75 152.12 33.85 Favored 'General case' 0 N--CA 1.446 -0.625 0 N-CA-C 104.701 -2.333 . . . . 0.0 104.701 149.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.401 HG12 ' HE ' ' A' ' 117' ' ' ARG . 64.6 t -135.38 120.2 27.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 -176.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 2.2 mp -70.46 165.75 21.9 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 123.055 1.407 . . . . 0.0 111.079 178.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -53.94 -36.94 63.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 126.98 2.112 . . . . 0.0 111.273 171.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -81.82 -11.4 58.98 Favored 'General case' 0 C--O 1.226 -0.166 0 O-C-N 120.915 -1.116 . . . . 0.0 110.431 -176.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 104.05 12.11 30.43 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 123.981 0.801 . . . . 0.0 113.902 -177.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.18 166.19 5.08 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.172 1.486 . . . . 0.0 110.57 174.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 25.1 m -151.09 99.5 2.69 Favored 'General case' 0 C--O 1.237 0.409 0 O-C-N 120.405 -1.434 . . . . 0.0 109.956 -176.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 10.1 mp -78.05 166.45 22.8 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 121.119 -0.988 . . . . 0.0 109.769 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 18.3 m -132.47 120.91 22.56 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 173.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -119.53 156.6 29.98 Favored 'General case' 0 C--O 1.235 0.315 0 O-C-N 123.844 0.715 . . . . 0.0 110.09 168.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.03 131.09 53.55 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 126.863 2.065 . . . . 0.0 108.514 -178.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.24 110.55 2.62 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 125.341 1.457 . . . . 0.0 110.427 -176.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -133.91 73.69 1.51 Allowed 'General case' 0 C--O 1.227 -0.117 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 170.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 1.3 m -88.54 37.45 0.83 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 168.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.156 0 O-C-N 119.97 -1.706 . . . . 0.0 111.042 -172.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 9.4 pt . . . . . 0 CA--C 1.539 0.555 0 CA-C-O 119.665 -0.207 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.36 63.71 8.79 Favored 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 122.294 1.996 . . . . 0.0 111.069 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp 62.49 112.86 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.755 2.022 . . . . 0.0 109.239 -168.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -57.48 160.48 7.24 Favored Pre-proline 0 CA--C 1.534 0.357 0 C-N-CA 123.407 0.683 . . . . 0.0 111.449 -177.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.07 -7.17 20.82 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.123 1.882 . . . . 0.0 113.044 173.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 t70 74.42 163.01 0.26 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 128.042 2.537 . . . . 0.0 112.15 174.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.4 m 59.94 11.2 2.48 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 128.003 2.521 . . . . 0.0 114.878 173.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -89.76 58.24 4.19 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 126.398 1.879 . . . . 0.0 110.39 -170.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.62 80.46 2.0 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-O 122.518 1.151 . . . . 0.0 109.863 177.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 t 56.28 51.53 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 127.572 2.349 . . . . 0.0 110.45 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -65.81 144.79 98.97 Favored Pre-proline 0 C--O 1.238 0.449 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.667 172.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -72.87 151.4 50.92 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.932 2.421 . . . . 0.0 109.622 -175.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -93.82 144.76 28.67 Favored Pre-proline 0 C--O 1.24 0.569 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -66.04 -176.97 0.69 Allowed 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.307 2.671 . . . . 0.0 110.537 164.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 65.48 167.2 0.19 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 126.56 1.944 . . . . 0.0 112.698 177.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -142.03 143.31 27.65 Favored Pre-proline 0 N--CA 1.457 -0.106 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.734 -173.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -75.24 -35.79 2.78 Favored 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.493 2.128 . . . . 0.0 111.212 179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.48 72.96 1.01 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.523 1.929 . . . . 0.0 108.94 175.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.672 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -173.51 -37.07 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 129.672 3.189 . . . . 0.0 108.037 174.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.5 m -63.31 -22.99 67.22 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.177 -0.952 . . . . 0.0 111.689 177.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -56.8 -15.99 5.75 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.499 1.12 . . . . 0.0 113.416 174.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 74.0 mt -98.42 5.14 48.35 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.683 1.193 . . . . 0.0 111.853 -176.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.409 HD13 ' HE1' ' A' ' 28' ' ' TRP . 0.7 OUTLIER -75.11 75.01 2.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.939 1.696 . . . . 0.0 108.571 178.0 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -143.96 -29.29 0.5 Allowed 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 168.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.5 p-10 -111.24 -5.52 14.69 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.892 1.277 . . . . 0.0 112.665 173.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 75.4 p -71.26 176.05 4.86 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.811 1.244 . . . . 0.0 110.814 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.3 OUTLIER -138.3 -64.67 0.52 Allowed 'General case' 0 CA--C 1.512 -0.501 0 O-C-N 120.594 -1.316 . . . . 0.0 110.696 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.409 ' HE1' HD13 ' A' ' 23' ' ' LEU . 4.3 m95 67.77 163.01 0.2 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 125.974 1.71 . . . . 0.0 112.949 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 87.1 t -140.83 136.41 34.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 N-CA-C 105.226 -2.138 . . . . 0.0 105.226 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 48.5 tp -85.26 135.58 33.86 Favored 'General case' 0 C--O 1.238 0.476 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 176.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -139.92 -12.61 1.1 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 114.26 1.208 . . . . 0.0 114.26 176.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -143.98 151.51 39.84 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.762 1.619 . . . . 0.0 111.714 172.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -142.17 101.16 3.87 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.31 1.844 . . . . 0.0 106.813 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.51 140.44 29.53 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 121.075 -1.016 . . . . 0.0 108.556 170.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.403 ' HA ' ' CG ' ' A' ' 136' ' ' ASP . 18.5 mt-30 -78.67 170.13 17.15 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.823 0.738 . . . . 0.0 111.542 166.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -57.41 -21.8 38.89 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.313 2.245 . . . . 0.0 114.757 -177.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -111.08 1.86 17.59 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 119.528 1.058 . . . . 0.0 112.049 174.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 117.36 0.67 18.58 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 124.054 0.835 . . . . 0.0 113.795 170.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 2.2 m -67.62 95.29 0.47 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.156 1.478 . . . . 0.0 110.156 -175.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.35 107.08 1.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 O-C-N 120.16 -1.587 . . . . 0.0 111.091 171.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 2.5 mtp180 -65.72 159.9 24.06 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.974 1.709 . . . . 0.0 110.94 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -81.06 129.24 34.46 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 170.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.9 m -137.52 164.73 39.43 Favored Pre-proline 0 C--O 1.236 0.39 0 C-N-CA 123.824 0.85 . . . . 0.0 109.148 -175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.08 112.97 3.6 Favored 'Trans proline' 0 N--CA 1.452 -0.948 0 C-N-CA 121.947 1.765 . . . . 0.0 110.478 169.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.4 p -64.74 178.09 0.84 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.151 0.981 . . . . 0.0 110.245 162.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.76 99.8 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.396 -0.815 . . . . 0.0 110.241 165.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -65.27 -32.24 73.8 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 125.332 1.453 . . . . 0.0 110.91 -174.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 86.8 mm-40 -59.5 -12.99 7.28 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 126.219 1.808 . . . . 0.0 113.479 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.22 -45.16 1.36 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 124.098 0.856 . . . . 0.0 111.563 165.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -129.88 77.89 75.98 Favored Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.447 1.499 . . . . 0.0 109.087 -175.107 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.22 154.72 69.44 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 124.569 3.513 . . . . 0.0 112.138 173.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 2.2 mt -79.45 100.07 3.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 C-N-CA 124.051 0.94 . . . . 0.0 108.472 171.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.3 p -92.14 154.78 18.48 Favored 'General case' 0 C--O 1.241 0.647 0 O-C-N 121.816 -0.552 . . . . 0.0 110.068 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 27.3 tp -121.28 155.33 34.91 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 126.068 1.747 . . . . 0.0 106.882 173.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 27' ' ' SER . 8.9 m -147.78 99.48 3.1 Favored 'General case' 0 C--O 1.233 0.207 0 O-C-N 121.568 -0.707 . . . . 0.0 109.667 176.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.89 125.35 29.14 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 173.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.06 -164.34 1.59 Allowed 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 175.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.0 p -139.16 24.15 2.54 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 128.737 2.815 . . . . 0.0 110.679 -169.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 88.9 p -68.62 0.44 4.15 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -167.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.0 p -117.5 1.5 12.32 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.962 1.705 . . . . 0.0 110.933 171.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 110.4 -48.35 0.95 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 127.447 2.451 . . . . 0.0 110.564 -176.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -93.26 170.68 9.44 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 125.751 1.62 . . . . 0.0 109.157 -169.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -73.55 101.44 3.57 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 174.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -124.23 141.95 51.65 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -107.12 100.59 10.06 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 126.364 1.866 . . . . 0.0 106.715 179.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 7.2 t -108.35 148.43 30.09 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.232 -1.395 . . . . 0.0 107.232 164.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -161.38 -162.13 12.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 106.799 -2.52 . . . . 0.0 106.799 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.412 ' HA ' ' HB3' ' A' ' 73' ' ' ARG . 77.0 t80 -108.37 -11.99 15.11 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 115.729 1.752 . . . . 0.0 115.729 -171.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 67.2 m 51.52 -164.96 0.05 Allowed 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 129.886 3.274 . . . . 0.0 111.601 -172.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . -52.49 -30.23 33.39 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 125.444 1.497 . . . . 0.0 113.247 172.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 11.0 t -174.91 0.06 0.01 OUTLIER 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.486 0.715 . . . . 0.0 112.258 162.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -125.68 102.74 7.48 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-O 123.665 1.698 . . . . 0.0 109.575 -175.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.412 ' HB3' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -55.5 132.44 48.49 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 113.339 -1.755 . . . . 0.0 111.945 -171.853 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 6.3 p90 -113.07 165.14 12.65 Favored 'General case' 0 CA--C 1.507 -0.71 0 C-N-CA 128.153 2.581 . . . . 0.0 109.446 -164.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.5 mtm -152.45 156.59 39.77 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 105.512 -2.033 . . . . 0.0 105.512 178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 158.69 175.83 30.06 Favored Glycine 0 C--N 1.318 -0.44 0 C-N-CA 124.607 1.099 . . . . 0.0 110.397 173.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 6.4 m -87.48 165.24 15.67 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 122.092 -0.652 . . . . 0.0 110.927 -173.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 32.9 p90 -145.96 178.33 8.27 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.224 1.009 . . . . 0.0 111.055 173.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -159.07 155.89 28.21 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 126.073 1.749 . . . . 0.0 109.569 174.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 3.3 mp -112.31 127.08 55.89 Favored 'General case' 0 CA--C 1.509 -0.601 0 C-N-CA 125.512 1.525 . . . . 0.0 107.754 175.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -165.84 169.36 15.01 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 124.795 1.238 . . . . 0.0 109.317 171.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.6 t0 44.66 44.88 7.77 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.739 1.616 . . . . 0.0 113.477 168.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 64.82 0.66 5.39 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 115.585 0.994 . . . . 0.0 115.585 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.0 pttt -127.33 172.2 10.84 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 126.227 1.811 . . . . 0.0 112.013 -166.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.03 103.31 9.78 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 -174.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.4 m -90.86 151.51 21.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.47 ' HB3' HD21 ' A' ' 90' ' ' LEU . 82.5 m-85 -118.08 -179.83 3.88 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 123.485 0.714 . . . . 0.0 110.698 -178.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -107.61 -105.32 3.0 Favored Glycine 0 CA--C 1.52 0.397 0 N-CA-C 109.667 -1.373 . . . . 0.0 109.667 176.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 7.0 m -140.91 71.62 1.37 Allowed 'General case' 0 CA--C 1.514 -0.405 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 -169.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.626 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -63.33 167.04 5.64 Favored 'General case' 0 N--CA 1.423 -1.816 0 CA-C-O 121.528 0.68 . . . . 0.0 111.033 -177.698 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 160.79 170.95 26.08 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 107.711 -2.155 . . . . 0.0 107.711 174.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -155.42 -156.08 7.62 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 -160.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 38.4 p -76.88 -179.69 5.61 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 122.255 -0.556 . . . . 0.0 109.622 165.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -133.68 86.98 2.33 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 163.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 10.0 mtt -80.52 154.46 27.51 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -66.47 140.39 58.01 Favored 'General case' 0 N--CA 1.443 -0.817 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 159.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.275 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 98.9 m -142.71 -19.27 0.67 Allowed 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.481 1.113 . . . . 0.0 113.392 172.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 34.0 mtm 62.18 25.57 15.31 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.38 1.072 . . . . 0.0 113.739 171.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 26.7 p -123.81 161.56 45.81 Favored Pre-proline 0 C--O 1.24 0.562 0 C-N-CA 125.909 1.683 . . . . 0.0 110.233 -176.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.27 -33.0 19.42 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.68 2.253 . . . . 0.0 111.231 171.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -60.14 -33.75 81.07 Favored Glycine 0 CA--C 1.531 1.048 0 C-N-CA 123.967 0.794 . . . . 0.0 111.524 172.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -60.92 -43.19 99.65 Favored Glycine 0 CA--C 1.531 1.034 0 CA-C-N 118.076 0.938 . . . . 0.0 112.42 172.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.8 mt-30 -85.85 -33.25 21.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.138 0.969 . . . . 0.0 112.895 -170.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 17.6 tt -61.01 -18.29 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 118.819 0.736 . . . . 0.0 111.599 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -56.96 -36.21 70.02 Favored 'General case' 0 N--CA 1.444 -0.753 0 O-C-N 121.352 -0.842 . . . . 0.0 111.858 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -58.86 -26.55 60.7 Favored Glycine 0 CA--C 1.528 0.884 0 CA-C-O 119.282 -0.732 . . . . 0.0 112.414 176.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -86.26 -40.17 15.81 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 118.697 1.249 . . . . 0.0 110.601 173.651 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.57 -30.54 57.07 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 -158.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 66.1 mt -60.41 -38.94 85.6 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.808 1.243 . . . . 0.0 110.068 175.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.93 -36.95 67.34 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 122.782 0.433 . . . . 0.0 110.361 178.695 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -60.73 -24.95 66.09 Favored 'General case' 0 CA--C 1.54 0.595 0 O-C-N 122.083 -0.385 . . . . 0.0 111.288 176.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 98.0 mt -69.88 -7.32 39.25 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 118.12 -0.943 . . . . 0.0 113.349 174.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 27.7 p -94.77 -11.68 28.54 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 120.789 1.631 . . . . 0.0 112.317 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -113.54 35.31 4.08 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.169 0.987 . . . . 0.0 110.782 -172.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 2.8 mm -72.15 72.96 0.19 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.455 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 175.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -75.92 -35.15 59.86 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 169.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -127.54 160.71 30.69 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 124.138 0.975 . . . . 0.0 110.731 -173.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 19.3 m -151.35 158.11 43.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 124.604 1.162 . . . . 0.0 107.961 169.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -146.51 108.37 0.44 Allowed Glycine 0 N--CA 1.441 -1.018 0 N-CA-C 109.132 -1.587 . . . . 0.0 109.132 172.504 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' ' 19' ' ' ALA . 5.4 p -108.5 156.19 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 118.936 1.368 . . . . 0.0 111.174 169.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -136.92 112.07 9.06 Favored 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 179.33 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 39.5 ttm -108.45 66.99 0.65 Allowed 'General case' 0 C--O 1.233 0.228 0 C-N-CA 125.514 1.526 . . . . 0.0 109.385 179.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 5.6 ttp180 -152.69 80.6 1.22 Allowed 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 124.789 1.236 . . . . 0.0 109.458 175.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -27.88 119.94 0.26 Allowed Pre-proline 0 CA--C 1.535 0.402 0 C-N-CA 127.697 2.399 . . . . 0.0 112.437 -175.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -79.56 122.72 8.81 Favored 'Cis proline' 0 N--CA 1.457 -0.62 0 CA-C-N 119.317 0.792 . . . . 0.0 111.758 15.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -83.28 141.91 31.49 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -172.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -141.53 170.13 16.31 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 161.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 6.5 tmm? -143.22 142.34 31.38 Favored 'General case' 0 N--CA 1.441 -0.883 0 C-N-CA 127.732 2.413 . . . . 0.0 105.226 -178.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -135.15 129.08 33.27 Favored 'General case' 0 N--CA 1.435 -1.197 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 -174.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 97.1 mt -103.86 140.4 37.72 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 168.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 55.7 t -127.22 123.67 62.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.017 -1.846 . . . . 0.0 106.017 -176.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 17.7 mt -75.94 165.2 25.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -59.66 -33.15 71.18 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.578 171.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.05 -21.88 39.74 Favored 'General case' 0 C--N 1.341 0.207 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.406 176.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 118.15 6.45 12.26 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-O 118.37 -1.239 . . . . 0.0 115.407 168.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . 0.403 ' CG ' ' HA ' ' A' ' 35' ' ' GLN . 1.4 m-20 -61.68 133.64 55.83 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.587 2.193 . . . . 0.0 108.72 174.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 99.4 m -116.33 103.36 10.4 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.845 2.058 . . . . 0.0 108.265 -169.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . . . . . . . . . 5.8 mp -94.55 114.18 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 51.1 m -86.03 124.31 32.32 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 170.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -99.35 163.4 12.55 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.484 1.514 . . . . 0.0 108.621 167.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -111.38 147.64 34.76 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.089 1.756 . . . . 0.0 108.279 163.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 22.2 tpt85 -81.15 109.41 15.67 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 175.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.8 t -91.27 108.52 19.94 Favored 'General case' 0 N--CA 1.444 -0.734 0 N-CA-C 105.03 -2.211 . . . . 0.0 105.03 163.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.77 16.77 17.33 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 127.693 2.397 . . . . 0.0 110.69 165.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.188 0 CA-C-O 116.52 -1.705 . . . . 0.0 107.126 164.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 24.6 pt . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 117.173 -1.394 . . . . 0.0 107.809 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -62.69 157.11 49.05 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 CA-C-N 120.124 1.08 . . . . 0.0 109.333 164.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 60.06 95.34 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 126.497 1.919 . . . . 0.0 110.48 -170.596 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.3 m80 -65.59 165.33 19.71 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.42 162.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -66.04 94.26 0.29 Allowed 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.39 2.06 . . . . 0.0 108.199 163.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -132.25 166.36 22.06 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 130.888 3.675 . . . . 0.0 106.207 177.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 51.3 m -144.37 0.54 1.03 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 177.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -86.85 42.64 1.03 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.636 1.208 . . . . 0.0 112.494 -167.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -89.67 50.8 1.96 Allowed 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.878 -1.139 . . . . 0.0 110.528 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 p -148.8 123.61 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 -179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -153.94 160.97 30.35 Favored Pre-proline 0 C--O 1.239 0.532 0 C-N-CA 123.393 0.677 . . . . 0.0 110.059 170.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -73.84 124.82 9.48 Favored 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.696 2.931 . . . . 0.0 110.319 169.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.82 144.97 45.98 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.102 -1.408 . . . . 0.0 110.373 -173.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -79.76 -164.4 0.28 Allowed 'Trans proline' 0 CA--C 1.542 0.898 1 C-N-CA 125.88 4.387 . . . . 0.0 113.045 -178.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 68.39 71.29 0.3 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 127.672 2.389 . . . . 0.0 110.505 175.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -94.25 144.63 28.33 Favored Pre-proline 0 C--O 1.232 0.152 0 CA-C-N 115.378 -0.828 . . . . 0.0 113.128 -166.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.1 -28.47 34.6 Favored 'Trans proline' 0 N--CA 1.456 -0.703 0 C-N-CA 122.669 2.246 . . . . 0.0 111.689 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.78 -21.14 64.32 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.77 0.828 . . . . 0.0 112.934 175.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.513 ' HB3' HG13 ' A' ' 120' ' ' VAL . . . -77.96 -16.67 57.98 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.221 -0.925 . . . . 0.0 111.71 176.135 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.536 ' HA ' ' CD2' ' A' ' 23' ' ' LEU . 1.2 t -72.79 -21.01 61.06 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.842 1.201 . . . . 0.0 110.451 -168.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLN . . . . . 0.413 HE21 ' N ' ' A' ' 21' ' ' GLN . 0.0 OUTLIER -75.76 3.4 9.9 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 120.01 -1.681 . . . . 0.0 110.743 -177.148 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.7 mt -121.56 29.2 7.31 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 127.095 2.158 . . . . 0.0 109.348 -173.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.574 HD21 HG11 ' A' ' 120' ' ' VAL . 3.8 mm? -103.09 74.1 1.28 Allowed 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.905 2.082 . . . . 0.0 105.896 167.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . 0.256 2.0 p30 -129.44 -62.54 0.97 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.353 -172.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -99.29 2.12 45.2 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.415 1.486 . . . . 0.0 110.804 171.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.99 162.18 29.84 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 126.698 1.999 . . . . 0.0 109.57 -171.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.1 m -156.08 144.12 19.75 Favored 'General case' 0 C--O 1.242 0.683 0 O-C-N 118.589 -2.569 . . . . 0.0 107.701 -173.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.468 ' HA ' ' O ' ' A' ' 141' ' ' ASP . 28.2 m95 -149.02 175.79 11.0 Favored 'General case' 0 CA--C 1.544 0.749 0 O-C-N 124.171 0.92 . . . . 0.0 112.192 -161.05 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.597 HG13 ' HB2' ' A' ' 141' ' ' ASP . 2.6 p -153.65 118.63 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 117.144 2.275 . . . . 0.0 117.144 174.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.587 HD11 HD12 ' A' ' 138' ' ' LEU . 7.5 tp -60.41 139.12 57.84 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.124 -175.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 t -145.63 -2.17 0.76 Allowed 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.251 -0.886 . . . . 0.0 113.274 171.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -150.43 157.35 42.93 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 120.036 1.289 . . . . 0.0 110.281 168.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TRP . . . . . 0.551 ' CD1' HD21 ' A' ' 138' ' ' LEU . 2.2 t90 -152.56 100.39 2.55 Favored 'General case' 0 CA--C 1.521 -0.154 0 C-N-CA 127.098 2.159 . . . . 0.0 105.829 172.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -86.66 142.84 27.93 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 170.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -81.99 170.94 14.99 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 164.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.16 -31.26 72.36 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 123.574 0.546 . . . . 0.0 111.502 -175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -86.08 3.13 43.87 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.802 1.641 . . . . 0.0 112.054 179.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.93 1.14 57.29 Favored Glycine 0 CA--C 1.524 0.605 0 O-C-N 120.746 -1.222 . . . . 0.0 112.789 167.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 17.4 m -67.01 95.74 0.4 Allowed 'General case' 0 N--CA 1.445 -0.716 0 C-N-CA 126.344 1.857 . . . . 0.0 109.407 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -60.77 112.4 2.01 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 120.958 -1.089 . . . . 0.0 109.759 165.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 19.7 mtp85 -71.7 149.6 45.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.378 1.071 . . . . 0.0 109.507 176.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -84.49 105.73 15.53 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 124.364 1.066 . . . . 0.0 109.164 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 19.9 m -113.51 152.26 45.19 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 125.872 1.669 . . . . 0.0 107.207 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -73.97 120.08 6.18 Favored 'Trans proline' 0 N--CA 1.454 -0.842 0 C-N-CA 121.887 1.724 . . . . 0.0 109.034 177.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.24 171.11 13.61 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.216 0.606 . . . . 0.0 110.119 171.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.22 -38.69 77.28 Favored 'General case' 0 C--O 1.233 0.213 0 O-C-N 121.895 -0.503 . . . . 0.0 110.459 169.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -75.84 -9.5 58.66 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.823 1.045 . . . . 0.0 113.823 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 85.5 mm-40 -81.57 -29.69 33.31 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.864 0.866 . . . . 0.0 111.803 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 144.51 -80.01 0.24 Allowed Glycine 0 C--N 1.336 0.529 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -170.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -125.07 85.23 58.24 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 125.163 1.385 . . . . 0.0 110.137 -168.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.47 152.44 75.1 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.187 1.925 . . . . 0.0 111.036 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 8.1 mt -78.03 101.7 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 107.354 -1.35 . . . . 0.0 107.354 178.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -89.9 177.78 6.4 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 120.225 1.375 . . . . 0.0 108.5 174.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.427 ' HG ' ' CE2' ' A' ' 140' ' ' PHE . 1.4 tm? -144.23 146.85 32.92 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 127.031 2.133 . . . . 0.0 106.966 -178.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -145.29 143.52 30.25 Favored 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 105.917 -1.882 . . . . 0.0 105.917 176.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.03 128.96 41.37 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 172.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.5 t -159.8 177.75 10.5 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.5 p -129.43 24.03 5.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.121 0.968 . . . . 0.0 112.574 -171.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -49.79 -31.44 11.67 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 115.322 1.601 . . . . 0.0 115.322 -179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.1 p -92.95 8.05 41.42 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.123 177.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 73.83 -0.46 51.15 Favored Glycine 0 CA--C 1.534 1.237 0 C-N-CA 125.21 1.386 . . . . 0.0 111.908 -166.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -117.89 161.6 19.49 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 126.037 1.735 . . . . 0.0 108.622 -174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mmt180 -75.56 63.47 1.53 Allowed 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 124.709 1.203 . . . . 0.0 109.832 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -82.96 110.64 18.12 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 120.801 1.637 . . . . 0.0 110.187 -170.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -81.66 152.5 27.09 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.668 -1.605 . . . . 0.0 107.257 159.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 5.5 p -141.94 -177.88 5.42 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 125.092 1.357 . . . . 0.0 107.964 161.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -179.16 168.39 39.1 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 163.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.461 ' HA ' ' HA ' ' A' ' 73' ' ' ARG . 5.7 t80 -89.75 138.35 31.56 Favored 'General case' 0 CA--C 1.531 0.229 0 N-CA-C 106.047 -1.834 . . . . 0.0 106.047 160.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.5 t -118.71 71.44 0.85 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 174.557 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 70.01 -36.21 0.4 Allowed Glycine 0 CA--C 1.534 1.228 0 C-N-CA 126.975 2.226 . . . . 0.0 116.982 167.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 97' ' ' CYS . 7.6 t -146.49 -14.26 0.44 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.199 1.399 . . . . 0.0 111.893 163.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -130.06 115.52 17.22 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 106.434 -1.691 . . . . 0.0 106.434 -178.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 68' ' ' PHE . 0.0 OUTLIER -64.5 162.46 15.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.519 164.363 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 13.1 p90 -139.09 168.45 19.81 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 125.341 1.457 . . . . 0.0 109.223 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 3.8 ptp -152.16 172.81 15.79 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 127.098 2.159 . . . . 0.0 108.185 170.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 172.3 -143.62 7.52 Favored Glycine 0 CA--C 1.525 0.685 0 N-CA-C 107.654 -2.178 . . . . 0.0 107.654 168.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 57.1 m -125.26 161.23 27.4 Favored 'General case' 0 CA--C 1.545 0.762 0 CA-C-N 119.281 1.541 . . . . 0.0 112.777 165.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -128.62 173.62 10.13 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.228 1.011 . . . . 0.0 111.847 -178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -154.22 139.89 17.98 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 124.373 1.069 . . . . 0.0 110.349 -176.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -106.26 120.6 42.27 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.01 168.45 22.74 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 125.535 1.534 . . . . 0.0 109.226 169.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 34.9 t0 48.31 39.06 11.55 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.065 1.346 . . . . 0.0 113.713 167.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 63.3 13.14 48.32 Favored Glycine 0 CA--C 1.535 1.291 0 O-C-N 120.233 -1.542 . . . . 0.0 114.56 179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.9 pttt -134.65 164.8 26.7 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 119.244 1.522 . . . . 0.0 113.01 -177.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.0 tp -109.92 96.83 6.5 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 125.693 1.597 . . . . 0.0 106.812 -178.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 28.3 m -87.43 162.3 17.36 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.419 ' HB3' HD21 ' A' ' 90' ' ' LEU . 97.3 m-85 -139.3 155.92 47.4 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 125.773 1.629 . . . . 0.0 109.166 -176.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -77.11 -106.6 0.15 Allowed Glycine 0 CA--C 1.528 0.847 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 170.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 11.5 t -143.83 58.84 1.37 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 122.232 1.015 . . . . 0.0 108.465 -154.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.706 HD22 ' H ' ' A' ' 90' ' ' LEU . 0.7 OUTLIER -60.45 153.11 23.94 Favored 'General case' 0 N--CA 1.432 -1.348 0 O-C-N 121.142 -0.974 . . . . 0.0 112.913 -165.805 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -172.78 173.1 45.42 Favored Glycine 0 N--CA 1.453 -0.201 0 N-CA-C 111.804 -0.518 . . . . 0.0 111.804 172.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -147.54 -117.29 0.97 Allowed Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 109.717 -1.353 . . . . 0.0 109.717 177.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.3 p -120.82 178.25 4.78 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.689 1.196 . . . . 0.0 110.928 175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 23.6 mtt85 -113.43 73.51 0.82 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.274 1.03 . . . . 0.0 108.68 177.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 9.6 mtt -74.58 176.99 6.37 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.038 -1.039 . . . . 0.0 109.342 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -132.43 147.74 52.39 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 124.55 1.14 . . . . 0.0 109.679 173.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.262 ' SG ' ' SG ' ' A' ' 71' ' ' CYS . 9.9 m -136.41 -12.62 1.83 Allowed 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 126.17 1.788 . . . . 0.0 114.211 177.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 66.03 22.11 11.22 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 125.856 1.663 . . . . 0.0 113.36 176.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.2 p -110.41 165.3 12.93 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 124.009 0.924 . . . . 0.0 111.191 -165.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.92 -11.46 25.6 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.533 2.155 . . . . 0.0 112.768 164.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -93.05 -9.82 60.37 Favored Glycine 0 CA--C 1.533 1.171 0 CA-C-N 118.983 0.811 . . . . 0.0 112.881 168.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -72.11 -53.44 9.21 Favored Glycine 0 CA--C 1.526 0.734 0 CA-C-N 119.19 1.495 . . . . 0.0 112.487 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -88.2 -16.18 34.0 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 -167.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.6 tt -59.99 -17.98 14.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.296 170.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -44.75 -55.18 5.53 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.002 1.321 . . . . 0.0 110.06 170.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -73.63 -6.14 70.6 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.002 -0.888 . . . . 0.0 113.742 -173.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -87.08 -51.79 5.8 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.835 1.817 . . . . 0.0 109.005 162.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' TYR . . . . . . . . . . . . . 64.0 t80 -55.84 -47.62 76.91 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.799 1.24 . . . . 0.0 111.416 -171.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.98 -44.39 91.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 118.059 0.391 . . . . 0.0 110.388 177.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.44 -34.09 76.1 Favored 'General case' 0 N--CA 1.461 0.121 0 C-N-CA 123.548 0.739 . . . . 0.0 111.624 178.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.14 59.89 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.95 0.9 . . . . 0.0 112.564 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 62.9 mt -72.94 -8.21 54.6 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 119.475 1.034 . . . . 0.0 112.257 172.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 13.7 p -83.75 -5.07 59.11 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.191 -0.943 . . . . 0.0 111.768 175.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 37.9 m-70 -127.33 83.33 2.16 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 127.064 2.146 . . . . 0.0 107.283 -169.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 1.2 mm -122.18 59.41 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.228 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -70.41 -22.88 62.68 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.895 177.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 32.2 mtp85 -135.09 165.76 24.62 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.767 1.627 . . . . 0.0 111.095 -178.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 11.2 m -159.93 170.17 21.95 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.757 1.623 . . . . 0.0 109.019 176.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . -160.06 83.42 0.13 Allowed Glycine 0 C--N 1.336 0.547 0 C-N-CA 125.01 1.29 . . . . 0.0 110.037 168.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.574 HG11 HD21 ' A' ' 23' ' ' LEU . 2.4 p -81.3 151.48 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 119.475 1.637 . . . . 0.0 109.898 168.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -127.0 90.84 3.22 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 125.701 1.6 . . . . 0.0 107.603 175.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 35.2 ttm -77.72 73.29 4.29 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-O 122.292 1.044 . . . . 0.0 109.25 169.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 -151.45 143.42 23.88 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.574 -2.009 . . . . 0.0 105.574 162.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -65.07 133.44 95.7 Favored Pre-proline 0 CA--C 1.544 0.725 0 CA-C-N 119.72 1.145 . . . . 0.0 108.732 173.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -75.49 117.76 4.96 Favored 'Cis proline' 0 N--CA 1.455 -0.781 0 CA-C-N 120.289 1.139 . . . . 0.0 110.923 -2.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -71.21 132.51 45.09 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 -172.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -144.08 163.23 34.16 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.234 1.014 . . . . 0.0 108.636 173.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' MET . . . . . . . . . . . . . 50.0 ttp -126.44 115.45 19.62 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 174.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 62.3 mt-30 -86.31 148.7 25.49 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 158.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 38.0 mt -128.47 155.31 45.02 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 126.147 1.779 . . . . 0.0 106.455 167.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 54.2 t -141.45 125.67 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -174.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 6.7 mp -76.14 165.6 24.67 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 174.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -53.11 -30.77 38.4 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 125.985 1.714 . . . . 0.0 111.843 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.9 m-80 -72.14 -37.77 69.36 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.2 1.0 . . . . 0.0 109.019 -176.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 122.15 13.56 4.85 Favored Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.938 1.256 . . . . 0.0 113.873 -168.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.12 156.36 5.62 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 120.174 1.987 . . . . 0.0 110.204 174.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' THR . . . . . . . . . . . . . 2.8 m -126.45 97.62 5.11 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 177.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LEU . . . . . 0.587 HD12 HD11 ' A' ' 30' ' ' LEU . 0.4 OUTLIER -85.0 162.11 19.49 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 169.257 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 88.2 m -152.94 133.06 13.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 123.124 0.57 . . . . 0.0 109.565 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' PHE . . . . . 0.427 ' CE2' ' HG ' ' A' ' 54' ' ' LEU . 2.1 m-85 -126.31 156.01 41.08 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.597 1.559 . . . . 0.0 110.689 -176.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.597 ' HB2' HG13 ' A' ' 29' ' ' VAL . 0.1 OUTLIER -91.62 156.85 17.32 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 117.12 -1.419 . . . . 0.0 107.279 176.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 15.7 tpt85 -81.82 91.94 6.59 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 122.613 2.461 . . . . 0.0 109.706 163.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 26.6 t -81.72 90.18 6.33 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 166.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . . . . . . . . . 2.8 t -91.02 1.83 56.78 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 114.84 1.422 . . . . 0.0 114.84 175.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 12.8 ttt180 . . . . . 0 C--O 1.253 1.27 0 C-N-CA 129.752 3.221 . . . . 0.0 114.035 -174.261 . . . . . . . . 0 0 . 1 stop_ save_